<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <version>1.0</version>
  <creation_date>2010-04-08 22:13:31 UTC</creation_date>
  <update_date>2025-11-19 02:09:24 UTC</update_date>
  <accession>FDB018136</accession>
  <name>Sodium dimethyldithiocarbamate</name>
  <description>Antimicrobial agent used in cane-sugar and beet-sugar mills</description>
  <synonyms>
    <synonym>Aceto SDD 40</synonym>
    <synonym>Alcobam NM</synonym>
    <synonym>Amersep MP 3R</synonym>
    <synonym>Brogdex 555</synonym>
    <synonym>Carbam s</synonym>
    <synonym>Carbam-s</synonym>
    <synonym>Carbamic acid, dimethyldithio- sodium salt</synonym>
    <synonym>Carbamic acid, dimethyldithio- sodium salt (8CI)</synonym>
    <synonym>Carbamic acid, dimethyldithio-, sodium salt</synonym>
    <synonym>Carbamic acid, dimethyldithio-, sodium salt, dihydrate</synonym>
    <synonym>Carbamodithioic acid, dimethyl-, sodium salt</synonym>
    <synonym>Carbamodithioic acid, dimethyl-, sodium salt, dihydrate</synonym>
    <synonym>Carbamodithioic acid, N,N-dimethyl-, sodium salt (1:1)</synonym>
    <synonym>Diaprosim AB 13</synonym>
    <synonym>Dibam</synonym>
    <synonym>Dibam a</synonym>
    <synonym>Dimethylcarbamodithioic acid sodium salt, 9CI</synonym>
    <synonym>Dimethyldithiocarbamate sodium dihydrate</synonym>
    <synonym>Dimethyldithiocarbamate sodium salt</synonym>
    <synonym>Dimethyldithiocarbamate, sodium salt</synonym>
    <synonym>Dimethyldithiocarbamic acid sodium salt</synonym>
    <synonym>Dimethyldithiocarbamic acid sodium salt, 8CI</synonym>
    <synonym>Dimethyldithiocarbamic acid, sodium salt</synonym>
    <synonym>Diram</synonym>
    <synonym>DMDK</synonym>
    <synonym>MetalPlex 143</synonym>
    <synonym>Methyl namate</synonym>
    <synonym>MSL</synonym>
    <synonym>MSL (carbamate)</synonym>
    <synonym>N, n-dimethyldithiocarbamate sodium salt</synonym>
    <synonym>N,n-dimethyldithiocarbamate sodium salt</synonym>
    <synonym>N,n-dimethyldithiocarbamic acid, sodium salt</synonym>
    <synonym>Nalmet A 1</synonym>
    <synonym>Nocceler s</synonym>
    <synonym>Sanceler s</synonym>
    <synonym>SDDC</synonym>
    <synonym>Sdmdtc</synonym>
    <synonym>Sharstop 204</synonym>
    <synonym>Sodam</synonym>
    <synonym>Sodium dimethyl dithiocarbamate</synonym>
    <synonym>Sodium dimethylaminecarbodithioate</synonym>
    <synonym>Sodium dimethylaminocarbodithioate</synonym>
    <synonym>Sodium dimethylcarbamodithioate</synonym>
    <synonym>Sodium n, n-dimethyldithiocarbamate</synonym>
    <synonym>Sodium n,n-dimethyldithiocarbamate</synonym>
    <synonym>Sta-fresh 615</synonym>
    <synonym>Steriseal liquid #40</synonym>
    <synonym>Thiostop n</synonym>
    <synonym>Vinditat</synonym>
    <synonym>Vinstop</synonym>
    <synonym>Vulnopol NM</synonym>
    <synonym>Wing stop b</synonym>
  </synonyms>
  <chemical_formula>C3H6NNaS2</chemical_formula>
  <average_molecular_weight>143.206</average_molecular_weight>
  <monisotopic_moleculate_weight>142.983935252</monisotopic_moleculate_weight>
  <iupac_name>N,N-dimethyl(sodiosulfanyl)carbothioamide</iupac_name>
  <traditional_iupac>N,N-dimethylsodiosulfanylcarbothioamide</traditional_iupac>
  <cas_registry_number>128-04-1</cas_registry_number>
  <smiles>CN(C)C(=S)S[Na]</smiles>
  <inchi>InChI=1S/C3H7NS2.Na/c1-4(2)3(5)6;/h1-2H3,(H,5,6);/q;+1/p-1</inchi>
  <inchikey>VMSRVIHUFHQIAL-UHFFFAOYSA-M</inchikey>
  <taxonomy>
    <description> belongs to the class of organic compounds known as organic alkali metal salts. These are organic salts of an alkali metal. The alkali metal atom is usually in its ionic form.</description>
    <direct_parent>Organic alkali metal salts</direct_parent>
    <kingdom>Organic compounds</kingdom>
    <super_class>Organic salts</super_class>
    <class>Organic metal salts</class>
    <sub_class>Organic alkali metal salts</sub_class>
    <molecular_framework>Aliphatic acyclic compounds</molecular_framework>
    <alternative_parents>
      <alternative_parent>Hydrocarbon derivatives</alternative_parent>
      <alternative_parent>Organic sodium salts</alternative_parent>
      <alternative_parent>Organonitrogen compounds</alternative_parent>
      <alternative_parent>Organopnictogen compounds</alternative_parent>
      <alternative_parent>Organosulfur compounds</alternative_parent>
    </alternative_parents>
    <substituents>
      <substituent>Aliphatic acyclic compound</substituent>
      <substituent>Hydrocarbon derivative</substituent>
      <substituent>Organic alkali metal salt</substituent>
      <substituent>Organic nitrogen compound</substituent>
      <substituent>Organic sodium salt</substituent>
      <substituent>Organonitrogen compound</substituent>
      <substituent>Organopnictogen compound</substituent>
      <substituent>Organosulfur compound</substituent>
    </substituents>
    <external_descriptors>
    </external_descriptors>
  </taxonomy>
  <state/>
  <predicted_properties>
    <property>
      <kind>logp</kind>
      <value>0.63</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>logs</kind>
      <value>-1.40</value>
      <source>ALOGPS</source>
    </property>
    <property>
      <kind>solubility</kind>
      <value>5.71e+00 g/l</value>
      <source>ALOGPS</source>
    </property>
  </predicted_properties>
  <experimental_properties>
  </experimental_properties>
  <property>
    <kind>logp</kind>
    <value>-0.26</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>iupac</kind>
    <value>N,N-dimethyl(sodiosulfanyl)carbothioamide</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>average_mass</kind>
    <value>143.206</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>mono_mass</kind>
    <value>142.983935252</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>smiles</kind>
    <value>CN(C)C(=S)S[Na]</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>formula</kind>
    <value>C3H6NNaS2</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>inchi</kind>
    <value>InChI=1S/C3H7NS2.Na/c1-4(2)3(5)6;/h1-2H3,(H,5,6);/q;+1/p-1</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>inchikey</kind>
    <value>VMSRVIHUFHQIAL-UHFFFAOYSA-M</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>polar_surface_area</kind>
    <value>3.24</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>refractivity</kind>
    <value>34.62</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>polarizability</kind>
    <value>14.02</value>
    <source>ChemAxon</source>
  </property>
  <property>
    <kind>rotatable_bond_count</kind>
    <value>1</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::MsMs</type>
      <spectrum_id>1285339</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1285340</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1285341</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1400149</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1400150</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>1400151</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>3606323</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>3606324</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>3606325</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>3606326</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>3606327</spectrum_id>
    </spectrum>
    <spectrum>
      <type>Specdb::MsMs</type>
      <spectrum_id>3606328</spectrum_id>
    </spectrum>
  </spectra>
  <hmdb_id/>
  <pubchem_compound_id/>
  <chemspider_id/>
  <kegg_id/>
  <chebi_id/>
  <biocyc_id/>
  <het_id/>
  <wikipidia/>
  <vmh_id/>
  <fbonto_id/>
  <foodb_id/>
  <general_references>
  </general_references>
  <foods>
  </foods>
  <flavors>
  </flavors>
  <enzymes>
  </enzymes>
  <health_effects>
  </health_effects>
</compound>
