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

Structure

InChI Key FPDXRQODEPQHSK-UHFFFAOYSA-N
Smiles ClCC1=CC=C(C=C1)CC[Si](Cl)(C)C
InChI
InChI=1/C11H16Cl2Si/c1-14(2,13)8-7-10-3-5-11(9-12)6-4-10/h3-6H,7-9H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H16Cl2Si
Molecular Weight 246.04
AlogP 4.41
Number of Rotational Bond 4.0
Heavy Atoms 14.0

Cross References

Resources Reference
CAS NUMBER 74143-32-1
NORMAN SUSDAT
PubChem 106578