Record Information
Version1.0
Creation date2010-04-08 22:10:41 UTC
Update date2015-07-20 22:58:45 UTC
Primary IDFDB013396
Secondary Accession NumbersNot Available
Chemical Information
FooDB NameAmmonium hydroxide
DescriptionUsed in food processing as a leavening agent, pH control agent, surface-finishing agent, and boiler water additive
CAS Number1336-21-6
Structure
Thumb
Synonyms
SynonymSource
Ammonia aqueousdb_source
Ammonia waterbiospider
Ammonia, aquabiospider
Ammonia, aqueousbiospider
Ammonia, monohydratebiospider
Ammonium hydroxidedb_source
Aqua ammoniadb_source
Aquammoniabiospider
E527db_source
Predicted Properties
PropertyValueSource
logP-0.98ChemAxon
pKa (Strongest Basic)8.86ChemAxon
Physiological Charge1ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count1ChemAxon
Polar Surface Area0 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity16.31 m³·mol⁻¹ChemAxon
Polarizability2.38 ųChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleYesChemAxon
Chemical FormulaH5NO
IUPAC nameammonium hydroxide
InChI IdentifierInChI=1S/H3N.H2O/h1H3;1H2
InChI KeyInChIKey=VHUUQVKOLVNVRT-UHFFFAOYSA-N
Isomeric SMILES[NH4+].[OH-]
Average Molecular Weight35
Monoisotopic Molecular Weight35
Classification
DescriptionThis compound belongs to the class of inorganic compounds known as non-metal hydroxides. These are inorganic non-metallic compoundscontaining the hydroxide group as its largest oxoanion.
KingdomInorganic compounds
Super ClassHomogeneous non-metal compounds
ClassNon-metal oxoanionic compounds
Sub ClassNon-metal hydroxides
Direct ParentNon-metal hydroxides
Alternative Parents
Substituents
  • Non-metal hydroxide
  • Quaternary ammonium salt
  • Inorganic hydride
  • Inorganic oxide
  • Inorganic salt
  • Amine
  • Acyclic compound
Molecular FrameworkAcyclic compounds
External Descriptors
Physico-Chemical Properties - Experimental
Physico-Chemical Properties - Experimental
PropertyValueReference
Physical stateNot Available
Physical DescriptionNot Available
Mass CompositionH 14.38%; N 39.97%; O 45.65%DFC
Melting PointMp -77°DFC
Boiling PointNot Available
Experimental Water SolubilityNot Available
Experimental logPNot Available
Experimental pKaNot Available
Isoelectric pointNot Available
ChargeNot Available
Optical RotationNot Available
Spectroscopic UV DataNot Available
Densityd20 0.89DFC
Refractive IndexNot Available
Spectra
Spectra
Spectrum TypeDescriptionSplash Key
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-000i-9000000000-33c04c55b9ccccd960a2View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-000i-9000000000-33c04c55b9ccccd960a2View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-000i-9000000000-33c04c55b9ccccd960a2View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-001i-9000000000-60c03f5b2d0e63f2e367View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-001i-9000000000-60c03f5b2d0e63f2e367View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-001i-9000000000-60c03f5b2d0e63f2e367View in MoNA
ChemSpider IDNot Available
ChEMBL IDNot Available
KEGG Compound IDC01358
Pubchem Compound ID14923
Pubchem Substance IDNot Available
ChEBI ID18219
Phenol-Explorer IDNot Available
DrugBank IDNot Available
HMDB IDHMDB34832
CRC / DFC (Dictionary of Food Compounds) IDHVD34-P:HVD34-P
EAFUS ID178
Dr. Duke IDNot Available
BIGG IDNot Available
KNApSAcK IDNot Available
HET IDNot Available
Flavornet IDNot Available
GoodScent IDrw1219761
SuperScent IDNot Available
Wikipedia IDAmmonium_hydroxide
Phenol-Explorer Metabolite IDNot Available
Duplicate IDSNot Available
Old DFC IDSNot Available
Associated Foods
FoodContent Range AverageReference
FoodReference
Biological Effects and Interactions
Health Effects / BioactivitiesNot Available
EnzymesNot Available
PathwaysNot Available
MetabolismNot Available
BiosynthesisNot Available
Organoleptic Properties
FlavoursNot Available
Files
MSDSshow
References
Synthesis ReferenceNot Available
General ReferenceNot Available
Content Reference