Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID20199783

Structure

InChI Key GLISZRPOUBOZDL-UHFFFAOYSA-N
Smiles BrCCC[Si](OC)(OC)OC
InChI
InChI=1/C6H15BrO3Si/c1-8-11(9-2,10-3)6-4-5-7/h4-6H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H15BrO3Si
Molecular Weight 242.0
AlogP 1.65
Hydrogen Bond Acceptor 3.0
Number of Rotational Bond 6.0
Polar Surface Area 27.69
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 51826-90-5
NORMAN SUSDAT
PubChem 103984