Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID9074567

Structure

InChI Key JYWJULGYGOLCGW-UHFFFAOYSA-N
Smiles ClCOC(=O)Cl
InChI
InChI=1S/C2H2Cl2O2/c3-1-6-2(4)5/h1H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H2Cl2O2
Molecular Weight 127.94
AlogP 1.56
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 26.3
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 22128-62-7
NORMAN SUSDAT
PubChem 62754
ChemSpider 56498.0