Keyword(s): Human Metabolites
Molecule Category Free-form
UNII U9YPD2868R
EPA CompTox DTXSID00196295

Structure

InChI Key UYBPFKOKBLMDPV-UHFFFAOYSA-N
Smiles CC1(C)SSC(C)(C)SS1
InChI
InChI=1S/C6H12S4/c1-5(2)7-9-6(3,4)10-8-5/h1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H12S4
Molecular Weight 211.98
AlogP 4.24
Hydrogen Bond Acceptor 4.0
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 4475-72-3
NORMAN SUSDAT
FDA SRS U9YPD2868R
PubChem 73014
ChemSpider 65819.0