Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 49430BPM5B
EPA CompTox DTXSID0073164

Structure

InChI Key ATEBGNALLCMSGS-UHFFFAOYSA-N
Smiles FC(F)CCl
InChI
InChI=1S/C2H3ClF2/c3-1-2(4)5/h2H,1H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H3Cl1F2
Molecular Weight 99.99
AlogP 1.49
Number of Rotational Bond 1.0
Heavy Atoms 5.0

Cross References

Resources Reference
CAS NUMBER 338-65-8
NORMAN SUSDAT
FDA SRS 49430BPM5B
PubChem 2736499
ChemSpider 2018165.0