Keyword(s): Human Metabolites
Molecule Category Free-form
UNII ZF3W7R89YQ
EPA CompTox DTXSID00216846

Structure

InChI Key SJGGAMMXIZFWSF-UHFFFAOYSA-N
Smiles O=C(F)C(F)=C(F)F
InChI
InChI=1/C3F4O/c4-1(2(5)6)3(7)8

Physicochemical Descriptors

Property Name Value
Molecular Formula C3F4O
Molecular Weight 127.99
AlogP 1.56
Hydrogen Bond Acceptor 1.0
Number of Rotational Bond 1.0
Polar Surface Area 17.07
Heavy Atoms 8.0

Cross References

Resources Reference
CAS NUMBER 667-49-2
NORMAN SUSDAT
FDA SRS ZF3W7R89YQ
PubChem 3013928