Keyword(s): Human Metabolites
Molecule Category Free-form
UNII STQ49Q4PJQ
EPA CompTox DTXSID90171359

Structure

InChI Key ZCHHFMWUDHXPFN-UHFFFAOYSA-N
Smiles O=C(O[Si](C)(C)C)CBr
InChI
InChI=1/C5H11BrO2Si/c1-9(2,3)8-5(7)4-6/h4H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H11BrO2Si
Molecular Weight 209.97
AlogP 1.76
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 26.3
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 18291-80-0
NORMAN SUSDAT
FDA SRS STQ49Q4PJQ
PubChem 87554