Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID10241184

Structure

InChI Key RPBHMRVPUUGQCM-UHFFFAOYSA-N
Smiles FC(F)C(F)(F)OCCC[Si](OCC)(OCC)OCC
InChI
InChI=1/C11H22F4O4Si/c1-4-17-20(18-5-2,19-6-3)9-7-8-16-11(14,15)10(12)13/h10H,4-9H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H22F4O4Si
Molecular Weight 322.12
AlogP 3.3
Hydrogen Bond Acceptor 4.0
Number of Rotational Bond 12.0
Polar Surface Area 36.92
Heavy Atoms 20.0

Cross References

Resources Reference
CAS NUMBER 94232-72-1
NORMAN SUSDAT
PubChem 3024096