Keyword(s): Human Metabolites
Molecule Category Free-form
UNII G45S3149SQ
EPA CompTox DTXSID9075292

Structure

InChI Key UGOKVCVXNITPGA-UHFFFAOYSA-N
Smiles ON=C(Cl)Cl
InChI
InChI=1S/CHCl2NO/c2-1(3)4-5/h1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C1H1Cl2N1O1
Molecular Weight 112.94
AlogP 1.51
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 29.43
Heavy Atoms 5.0

Cross References

Resources Reference
CAS NUMBER 1794-86-1
NORMAN SUSDAT
FDA SRS G45S3149SQ