Keyword(s): Human Metabolites
Molecule Category Free-form
UNII A23U71SY9G
EPA CompTox DTXSID1029176

Structure

InChI Key PNQBEPDZQUOCNY-UHFFFAOYSA-N
Smiles FC(F)(F)C(Cl)=O
InChI
InChI=1S/C2ClF3O/c3-1(7)2(4,5)6

Physicochemical Descriptors

Property Name Value
Molecular Formula C2Cl1F3O1
Molecular Weight 131.96
AlogP 1.31
Hydrogen Bond Acceptor 1.0
Polar Surface Area 17.07
Heavy Atoms 7.0

Cross References

Resources Reference
CAS NUMBER 354-32-5
NORMAN SUSDAT
FDA SRS A23U71SY9G
PubChem 61106
ChemSpider 13870615.0