Keyword(s): Human Metabolites
Molecule Category Free-form
UNII DDU92CR3VW
EPA CompTox DTXSID80190837

Structure

InChI Key IZHPSCJEIFFRLN-UHFFFAOYSA-N
Smiles FC(F)(F)C(F)(F)C=C
InChI
InChI=1/C4H3F5/c1-2-3(5,6)4(7,8)9/h2H,1H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H3F5
Molecular Weight 146.02
AlogP 2.37
Number of Rotational Bond 1.0
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 374-27-6
NORMAN SUSDAT
FDA SRS DDU92CR3VW
PubChem 78990