Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 4O81R0SPR0
EPA CompTox DTXSID8063963

Structure

InChI Key CARJCVDELAMAEJ-UHFFFAOYSA-N
Smiles CC1SCCS1
InChI
InChI=1S/C4H8S2/c1-4-5-2-3-6-4/h4H,2-3H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H8S2
Molecular Weight 120.01
AlogP 1.81
Hydrogen Bond Acceptor 2.0
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 5616-51-3
NORMAN SUSDAT
FDA SRS 4O81R0SPR0
PubChem 21828
ChemSpider 20518.0