Record Information
Version1.0
Creation date2010-04-08 22:10:41 UTC
Update date2019-11-26 03:08:21 UTC
Primary IDFDB013397
Secondary Accession NumbersNot Available
Chemical Information
FooDB NameDiammonium sulfide
DescriptionDiammonium sulfide belongs to the class of inorganic compounds known as homogeneous other non-metal compounds. These are inorganic non-metallic compounds in which the largest atom belongs to the class of 'other non-metals'. Diammonium sulfide is a very strong basic compound (based on its pKa). Diammonium sulfide is a boiled egg, hard yolk, and sulfurous tasting compound. Diammonium sulfide has been detected, but not quantified in, cereals and cereal products and herbs and spices. This could make diammonium sulfide a potential biomarker for the consumption of these foods.
CAS Number12135-76-1
Structure
Thumb
Synonyms
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
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Chemical FormulaH8N2S
IUPAC namediammonium sulfanediide
InChI IdentifierInChI=1S/2H3N.S/h2*1H3;/q;;-2/p+2
InChI KeyUYJXRRSPUVSSMN-UHFFFAOYSA-P
Isomeric SMILES[NH4+].[NH4+].[S--]
Average Molecular Weight68.142
Monoisotopic Molecular Weight68.040818956
Classification
Description Belongs to the class of inorganic compounds known as homogeneous other non-metal compounds. These are inorganic non-metallic compounds in which the largest atom belongs to the class of 'other non-metals'.
KingdomInorganic compounds
Super ClassHomogeneous non-metal compounds
ClassHomogeneous other non-metal compounds
Sub ClassNot Available
Direct ParentHomogeneous other non-metal compounds
Alternative Parents
Substituents
  • Homogeneous other non metal
  • Inorganic salt
Molecular FrameworkNot Available
External DescriptorsNot Available
Ontology
Disposition

Route of exposure:

Source:

Role

Industrial application:

Biological role:

Physico-Chemical Properties
Physico-Chemical Properties - Experimental
Spectra
SpectraNot Available
ChemSpider IDNot Available
ChEMBL IDNot Available
KEGG Compound IDNot Available
Pubchem Compound ID25519
Pubchem Substance IDNot Available
ChEBI IDNot Available
Phenol-Explorer IDNot Available
DrugBank IDNot Available
HMDB IDHMDB34833
CRC / DFC (Dictionary of Food Compounds) IDHVD39-U:HVD39-U
EAFUS ID185
Dr. Duke IDNot Available
BIGG IDNot Available
KNApSAcK IDNot Available
HET IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
Flavornet IDNot Available
GoodScent IDrw1010461
SuperScent ID25519
Wikipedia IDNot Available
Phenol-Explorer Metabolite IDNot Available
Duplicate IDSNot Available
Old DFC IDSNot Available
Associated Foods
FoodContent Range AverageReference
Processing...
Biological Effects and Interactions
Health Effects / BioactivitiesNot Available
EnzymesNot Available
PathwaysNot Available
MetabolismNot Available
BiosynthesisNot Available
Organoleptic Properties
Flavours
Files
MSDSNot Available
References
Synthesis ReferenceNot Available
General ReferenceNot Available
Content Reference