Keyword(s): Human Metabolites
Molecule Category Free-form
EPA CompTox DTXSID5066407

Structure

InChI Key KWBZWRZCDGHBIQ-UHFFFAOYSA-N
Smiles O(CCO[Si](OCCOCCCC)(OCCOCCCC)OCCOCCCC)CCCC
InChI
InChI=1/C24H52O8Si/c1-5-9-13-25-17-21-29-33(30-22-18-26-14-10-6-2,31-23-19-27-15-11-7-3)32-24-20-28-16-12-8-4/h5-24H2,1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H52O8Si
Molecular Weight 496.34
AlogP 4.76
Hydrogen Bond Acceptor 8.0
Number of Rotational Bond 28.0
Polar Surface Area 73.84
Heavy Atoms 33.0

Cross References

Resources Reference
CAS NUMBER 18765-38-3
NORMAN SUSDAT
PubChem 87781