Keyword(s): Human Metabolites
Molecule Category Free-form
UNII XG32RK7L5Q
EPA CompTox DTXSID4074801

Structure

InChI Key YNHXBEVSSILHPI-UHFFFAOYSA-N
Smiles CN(C)P(=O)(Cl)Cl
InChI
InChI=1S/C2H6Cl2NOP/c1-5(2)7(3,4)6/h1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H6Cl2N1O1P1
Molecular Weight 160.96
AlogP 2.13
Hydrogen Bond Acceptor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 20.31
Heavy Atoms 7.0

Cross References

Resources Reference
CAS NUMBER 677-43-0
NORMAN SUSDAT
FDA SRS XG32RK7L5Q
PubChem 12673
ChemSpider 12152.0