Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID00397644

Structure

InChI Key JTRIUPVSQUCCHH-UHFFFAOYSA-N
Smiles C[S](=O)=O
InChI
InChI=1S/CH3O2S/c1-4(2)3/h1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C1H4O2S1
Molecular Weight 78.99
AlogP -0.29
Hydrogen Bond Acceptor 1.0
Polar Surface Area 36.97
Heavy Atoms 4.0

Cross References

Resources Reference
CAS NUMBER 43633-03-0
NORMAN SUSDAT
PubChem 57476620
ChemSpider 10612340.0