Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 8M12K3FU0T
EPA CompTox DTXSID8062234

Structure

InChI Key PUCHCUYBORIUSM-UHFFFAOYSA-N
Smiles CCCSSC
InChI
InChI=1S/C4H10S2/c1-3-4-6-5-2/h3-4H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H10S2
Molecular Weight 122.02
AlogP 2.41
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 3.0
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 2179-60-4
NORMAN SUSDAT
FDA SRS 8M12K3FU0T
PubChem 16592
ChemSpider 15732.0