Keyword(s): Human Metabolites
Molecule Category Free-form
UNII D37463NMIR
EPA CompTox DTXSID9064427

Structure

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

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H10S2
Molecular Weight 122.02
AlogP 1.71
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 3.0
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 6628-18-8
NORMAN SUSDAT
FDA SRS D37463NMIR
PubChem 23110
ChemSpider 21628.0