Keyword(s): Food Contact Chemicals
Molecule Category Free-form
EPA CompTox DTXSID901023579

Structure

InChI Key XXRDNYJWRWNIMR-UHFFFAOYSA-N
Smiles FC(F)=C(F)OC(F)(F)C(F)(F)CI
InChI
InChI=1S/C5H2F7IO/c6-2(7)3(8)14-5(11,12)4(9,10)1-13/h1H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H2F7IO
Molecular Weight 337.9
AlogP 3.7
Hydrogen Bond Acceptor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 9.23
Heavy Atoms 14.0

Cross References

Resources Reference
CAS NUMBER 106108-22-9
NORMAN SUSDAT
PubChem 21257258