Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID10864817

Structure

InChI Key IHXMXIBDDHNNRD-UHFFFAOYSA-N
Smiles ClCC(C)CC(OC)(OC)[SiH3]
InChI
InChI=1/C7H17ClO2Si/c1-6(5-8)4-7(11,9-2)10-3/h6H,4-5H2,1-3,11H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C7H17ClO2Si
Molecular Weight 196.07
AlogP 0.56
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 18.46
Heavy Atoms 11.0

Cross References

Resources Reference
CAS NUMBER 18244-20-7
NORMAN SUSDAT