Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 9191Y76OTC
EPA CompTox DTXSID5027146

Structure

InChI Key LJSQFQKUNVCTIA-UHFFFAOYSA-N
Smiles CCSCC
InChI
InChI=1S/C4H10S/c1-3-5-4-2/h3-4H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H10S1
Molecular Weight 90.05
AlogP 1.76
Hydrogen Bond Acceptor 1.0
Number of Rotational Bond 2.0
Heavy Atoms 5.0

Cross References

Resources Reference
CAS NUMBER 352-93-2
NORMAN SUSDAT
FDA SRS 9191Y76OTC
PubChem 9609
ChemSpider 9233.0