<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2010-04-08 22:05:56 UTC</creation_date>
  <update_date>2020-02-24 19:10:46 UTC</update_date>
  <accession>FDB003765</accession>
  <name>Bromine</name>
  <description>Bromine is a chemical element with the symbol Br, an atomic number of 35, and an atomic mass of 79.904. [Wikipedida]. Bromine is found in many foods, some of which are wild celery, pistachio, yellow bell pepper, and chinese cinnamon.</description>
  <synonyms>
    <synonym>Br2</synonym>
    <synonym>Brom</synonym>
    <synonym>Bromine atom</synonym>
  </synonyms>
  <chemical_formula>Br2</chemical_formula>
  <average_molecular_weight>159.808</average_molecular_weight>
  <monisotopic_moleculate_weight>157.836675294</monisotopic_moleculate_weight>
  <iupac_name>dibromane</iupac_name>
  <traditional_iupac>Brom</traditional_iupac>
  <cas_registry_number>7726-95-6</cas_registry_number>
  <smiles>BrBr</smiles>
  <inchi>InChI=1S/Br2/c1-2</inchi>
  <inchikey>GDTBXPJZTBHREO-UHFFFAOYSA-N</inchikey>
  <taxonomy>
    <description> belongs to the class of inorganic compounds known as homogeneous halogens. These are inorganic non-metallic compounds in which the largest atom is a nobel gas.</description>
    <direct_parent>Homogeneous halogens</direct_parent>
    <kingdom>Inorganic compounds</kingdom>
    <super_class>Homogeneous non-metal compounds</super_class>
    <class>Homogeneous halogens</class>
    <sub_class/>
    <molecular_framework/>
    <alternative_parents>
    </alternative_parents>
    <substituents>
      <substituent>Homogeneous halogen</substituent>
    </substituents>
    <external_descriptors>
      <external_descriptor>diatomic bromine</external_descriptor>
    </external_descriptors>
  </taxonomy>
  <state/>
  <predicted_properties>
  </predicted_properties>
  <experimental_properties>
  </experimental_properties>
  <property>
    <kind>logp</kind>
    <value>1.38</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>iupac</kind>
    <value>dibromane</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>average_mass</kind>
    <value>159.808</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>mono_mass</kind>
    <value>157.836675294</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>smiles</kind>
    <value>BrBr</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>formula</kind>
    <value>Br2</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>inchi</kind>
    <value>InChI=1S/Br2/c1-2</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>inchikey</kind>
    <value>GDTBXPJZTBHREO-UHFFFAOYSA-N</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>polar_surface_area</kind>
    <value>0</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>refractivity</kind>
    <value>17.47</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>polarizability</kind>
    <value>6.64</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>rotatable_bond_count</kind>
    <value>0</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>acceptor_count</kind>
    <value>0</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>donor_count</kind>
    <value>0</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>physiological_charge</kind>
    <value>0</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>formal_charge</kind>
    <value>0</value>
    <source>ChemAxon</source>
  </property>
  <pathways>
  </pathways>
  <spectra>
    <spectrum>
      <type>Specdb::CMs</type>
      <spectrum_id>18098</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::CMs</type>
      <spectrum_id>152202</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>72198</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>72199</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>72200</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>131037</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>131038</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>131039</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>2466944</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>2466945</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>2466946</spectrum_id>
    </spectrum>
  </spectra>
  <hmdb_id>HMDB31434</hmdb_id>
  <pubchem_compound_id/>
  <chemspider_id/>
  <kegg_id/>
  <chebi_id>22927</chebi_id>
  <biocyc_id/>
  <het_id/>
  <wikipidia/>
  <vmh_id/>
  <fbonto_id/>
  <foodb_id/>
  <general_references>
    <reference>#&lt;Reference:0x000055ce3323bd90&gt;</reference>
    <reference>#&lt;Reference:0x000055ce3323bbb0&gt;</reference>
    <reference>#&lt;Reference:0x000055ce3323b9a8&gt;</reference>
  </general_references>
  <foods>
    <food>
      <name>Almond</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Prunus dulcis</name_scientific>
      <ncbi_taxonomy_id>3755</ncbi_taxonomy_id>
      <average_value>2.0</average_value>
      <max_value>2.0</max_value>
      <min_value>2.0</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Apple</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Malus pumila</name_scientific>
      <ncbi_taxonomy_id>283210</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Bilberry</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Vaccinium myrtillus</name_scientific>
      <ncbi_taxonomy_id>180763</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Black walnut</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Juglans nigra</name_scientific>
      <ncbi_taxonomy_id>16719</ncbi_taxonomy_id>
      <average_value>0.25</average_value>
      <max_value>0.25</max_value>
      <min_value>0.25</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Blackcurrant</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Ribes nigrum</name_scientific>
      <ncbi_taxonomy_id>78511</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Brazil nut</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Bertholletia excelsa</name_scientific>
      <ncbi_taxonomy_id>3645</ncbi_taxonomy_id>
      <average_value>8.7</average_value>
      <max_value>8.7</max_value>
      <min_value>8.7</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Broccoli</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Brassica oleracea var. italica</name_scientific>
      <ncbi_taxonomy_id>36774</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Butternut</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Juglans cinerea</name_scientific>
      <ncbi_taxonomy_id>91214</ncbi_taxonomy_id>
      <average_value>0.15</average_value>
      <max_value>0.15</max_value>
      <min_value>0.15</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Cabbage</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Brassica oleracea var. capitata</name_scientific>
      <ncbi_taxonomy_id>3716</ncbi_taxonomy_id>
      <average_value>1.86</average_value>
      <max_value>1.86</max_value>
      <min_value>1.86</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Carrot</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Daucus carota ssp. sativus</name_scientific>
      <ncbi_taxonomy_id>79200</ncbi_taxonomy_id>
      <average_value>0.5</average_value>
      <max_value>0.5</max_value>
      <min_value>0.5</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Cashew nut</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Anacardium occidentale</name_scientific>
      <ncbi_taxonomy_id>171929</ncbi_taxonomy_id>
      <average_value>0.12</average_value>
      <max_value>0.12</max_value>
      <min_value>0.12</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Ceylon cinnamon</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Cinnamomum verum</name_scientific>
      <ncbi_taxonomy_id>128608</ncbi_taxonomy_id>
      <average_value>1.0</average_value>
      <max_value>1.0</max_value>
      <min_value>1.0</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Chinese cinnamon</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Cinnamomum aromaticum</name_scientific>
      <ncbi_taxonomy_id>119260</ncbi_taxonomy_id>
      <average_value>1.0</average_value>
      <max_value>1.0</max_value>
      <min_value>1.0</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Cloudberry</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Rubus chamaemorus</name_scientific>
      <ncbi_taxonomy_id>57936</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Coconut</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Cocos nucifera</name_scientific>
      <ncbi_taxonomy_id>13894</ncbi_taxonomy_id>
      <average_value>0.4</average_value>
      <max_value>0.4</max_value>
      <min_value>0.4</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Common bean</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Phaseolus vulgaris</name_scientific>
      <ncbi_taxonomy_id>3885</ncbi_taxonomy_id>
      <average_value>1.1</average_value>
      <max_value>1.1</max_value>
      <min_value>1.1</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Common grape</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Vitis vinifera</name_scientific>
      <ncbi_taxonomy_id>29760</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Common hazelnut</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Corylus avellana</name_scientific>
      <ncbi_taxonomy_id>13451</ncbi_taxonomy_id>
      <average_value>0.18</average_value>
      <max_value>0.18</max_value>
      <min_value>0.18</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Common pea</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Pisum sativum</name_scientific>
      <ncbi_taxonomy_id>3888</ncbi_taxonomy_id>
      <average_value>0.61</average_value>
      <max_value>0.61</max_value>
      <min_value>0.61</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Dandelion</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Taraxacum officinale</name_scientific>
      <ncbi_taxonomy_id>50225</ncbi_taxonomy_id>
      <average_value>5.5</average_value>
      <max_value>5.5</max_value>
      <min_value>5.5</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Dill</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Anethum graveolens</name_scientific>
      <ncbi_taxonomy_id>40922</ncbi_taxonomy_id>
      <average_value>0.35</average_value>
      <max_value>0.35</max_value>
      <min_value>0.35</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>European plum</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Prunus domestica</name_scientific>
      <ncbi_taxonomy_id>3758</ncbi_taxonomy_id>
    </food>
    <food>
      <name>French plantain</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Musa X paradisiaca</name_scientific>
      <ncbi_taxonomy_id>89151</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Garden onion</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Allium cepa</name_scientific>
      <ncbi_taxonomy_id>4679</ncbi_taxonomy_id>
      <average_value>0.8</average_value>
      <max_value>0.8</max_value>
      <min_value>0.8</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Garden rhubarb</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Rheum rhabarbarum</name_scientific>
      <ncbi_taxonomy_id>3621</ncbi_taxonomy_id>
      <average_value>1.05</average_value>
      <max_value>1.05</max_value>
      <min_value>1.05</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Giant butterbur</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Petasites japonicus</name_scientific>
      <ncbi_taxonomy_id>186965</ncbi_taxonomy_id>
      <average_value>2.9</average_value>
      <max_value>2.9</max_value>
      <min_value>2.9</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Gooseberry</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Ribes uva-crispa</name_scientific>
      <ncbi_taxonomy_id>135518</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Green bell pepper</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Capsicum annuum</name_scientific>
      <ncbi_taxonomy_id>4072</ncbi_taxonomy_id>
      <average_value>5.555</average_value>
      <max_value>5.555</max_value>
      <min_value>5.555</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Horseradish</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Armoracia rusticana</name_scientific>
      <ncbi_taxonomy_id>3704</ncbi_taxonomy_id>
      <average_value>1.2</average_value>
      <max_value>1.2</max_value>
      <min_value>1.2</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Lettuce</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Lactuca sativa</name_scientific>
      <ncbi_taxonomy_id>4236</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Mandarin orange (Clementine, Tangerine)</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Citrus reticulata</name_scientific>
      <ncbi_taxonomy_id>85571</ncbi_taxonomy_id>
      <average_value>0.1</average_value>
      <max_value>0.1</max_value>
      <min_value>0.1</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Mugwort</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Artemisia vulgaris</name_scientific>
      <ncbi_taxonomy_id>4220</ncbi_taxonomy_id>
      <average_value>2.5</average_value>
      <max_value>2.5</max_value>
      <min_value>2.5</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Orange bell pepper</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Capsicum annuum</name_scientific>
      <ncbi_taxonomy_id>4072</ncbi_taxonomy_id>
      <average_value>5.555</average_value>
      <max_value>5.555</max_value>
      <min_value>5.555</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Parsley</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Petroselinum crispum</name_scientific>
      <ncbi_taxonomy_id>4043</ncbi_taxonomy_id>
      <average_value>1.2</average_value>
      <max_value>1.2</max_value>
      <min_value>1.2</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Parsnip</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Pastinaca sativa</name_scientific>
      <ncbi_taxonomy_id>4041</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Peach</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Prunus persica</name_scientific>
      <ncbi_taxonomy_id>3760</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Pear</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Pyrus communis</name_scientific>
      <ncbi_taxonomy_id>23211</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Pepper</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Capsicum annuum</name_scientific>
      <ncbi_taxonomy_id>4072</ncbi_taxonomy_id>
      <average_value>5.555</average_value>
      <max_value>5.555</max_value>
      <min_value>5.555</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Pistachio</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Pistacia vera</name_scientific>
      <ncbi_taxonomy_id>55513</ncbi_taxonomy_id>
      <average_value>1.6</average_value>
      <max_value>1.6</max_value>
      <min_value>1.6</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Potato</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Solanum tuberosum</name_scientific>
      <ncbi_taxonomy_id>4113</ncbi_taxonomy_id>
      <average_value>1.51</average_value>
      <max_value>1.51</max_value>
      <min_value>1.51</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Radish</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Raphanus sativus</name_scientific>
      <ncbi_taxonomy_id>3726</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Red beetroot</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Beta vulgaris var. rubra</name_scientific>
      <ncbi_taxonomy_id/>
      <average_value>0.9</average_value>
      <max_value>0.9</max_value>
      <min_value>0.9</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Red bell pepper</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Capsicum annuum</name_scientific>
      <ncbi_taxonomy_id>4072</ncbi_taxonomy_id>
      <average_value>5.555</average_value>
      <max_value>5.555</max_value>
      <min_value>5.555</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Redcurrant</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Ribes rubrum</name_scientific>
      <ncbi_taxonomy_id>175228</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Spinach</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Spinacia oleracea</name_scientific>
      <ncbi_taxonomy_id>3562</ncbi_taxonomy_id>
      <average_value>0.4</average_value>
      <max_value>0.4</max_value>
      <min_value>0.4</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Sweet orange</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Citrus sinensis</name_scientific>
      <ncbi_taxonomy_id>2711</ncbi_taxonomy_id>
    </food>
    <food>
      <name>White cabbage</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Brassica oleracea L. var. capitata L. f. alba DC.</name_scientific>
      <ncbi_taxonomy_id/>
      <average_value>1.86</average_value>
      <max_value>1.86</max_value>
      <min_value>1.86</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Wild carrot</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Daucus carota</name_scientific>
      <ncbi_taxonomy_id>4039</ncbi_taxonomy_id>
      <average_value>0.5</average_value>
      <max_value>0.5</max_value>
      <min_value>0.5</min_value>
      <unit>mg/100 g</unit>
    </food>
    <food>
      <name>Wild celery</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Apium graveolens</name_scientific>
      <ncbi_taxonomy_id>4045</ncbi_taxonomy_id>
    </food>
    <food>
      <name>Yellow bell pepper</name>
      <food_type>Type 1</food_type>
      <category>specific</category>
      <name_scientific>Capsicum annuum</name_scientific>
      <ncbi_taxonomy_id>4072</ncbi_taxonomy_id>
      <average_value>5.555</average_value>
      <max_value>5.555</max_value>
      <min_value>5.555</min_value>
      <unit>mg/100 g</unit>
    </food>
  </foods>
  <flavors>
  </flavors>
  <enzymes>
  </enzymes>
  <health_effects>
  </health_effects>
</compound>
