Keyword(s): Human Metabolites
Molecule Category Free-form
UNII Y6TG7WF7OQ
EPA CompTox DTXSID0062634

Structure

InChI Key JMXMXKRNIYCNRV-UHFFFAOYSA-N
Smiles OCP(CO)CO
InChI
InChI=1S/C3H9O3P/c4-1-7(2-5)3-6/h4-6H,1-3H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C3H9O3P1
Molecular Weight 124.03
AlogP -0.68
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 3.0
Polar Surface Area 60.69
Heavy Atoms 7.0

Cross References

Resources Reference
CAS NUMBER 2767-80-8
NORMAN SUSDAT
FDA SRS Y6TG7WF7OQ
PubChem 76001
ChemSpider 68500.0