Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID50867347

Structure

InChI Key LUVQNLSOWISBKA-UHFFFAOYSA-N
Smiles O=P(OC)(OCCC[Si](OC)(OC)OC)C
InChI
InChI=1/C8H21O6PSi/c1-10-15(5,9)14-7-6-8-16(11-2,12-3)13-4/h6-8H2,1-5H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H21O6PSi
Molecular Weight 272.08
AlogP 1.74
Hydrogen Bond Acceptor 6.0
Number of Rotational Bond 9.0
Polar Surface Area 63.22
Heavy Atoms 16.0

Cross References

Resources Reference
CAS NUMBER 67812-17-3
NORMAN SUSDAT
PubChem 105669