Keyword(s): Human Metabolites
Molecule Category Free-form
UNII K6JU5FBY95
EPA CompTox DTXSID6059944

Structure

InChI Key VIYXXANHGYSBLY-UHFFFAOYSA-N
Smiles O=C(O[Si](C)(C)C)C(F)(F)F
InChI
InChI=1/C5H9F3O2Si/c1-11(2,3)10-4(9)5(6,7)8/h1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H9F3O2Si
Molecular Weight 186.03
AlogP 1.93
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 26.3
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 400-53-3
NORMAN SUSDAT
FDA SRS K6JU5FBY95
PubChem 67863