Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID5066324

Structure

InChI Key GPIARXZSVWTOMD-UHFFFAOYSA-N
Smiles N#CCCC[Si](Cl)(C)C
InChI
InChI=1/C6H12ClNSi/c1-9(2,7)6-4-3-5-8/h3-4,6H2,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H12ClNSi
Molecular Weight 161.04
AlogP 2.73
Hydrogen Bond Acceptor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 23.79
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 18156-15-5
NORMAN SUSDAT
PubChem 87478