diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane

C15H36O5Si3 — CID 138394933

IUPACdiethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane
SMILESCCCCCCCC[Si](OCC)(OCC)O[Si](=O)O[Si](C)(C)C
InChIInChI=1S/C15H36O5Si3/c1-7-10-11-12-13-14-15-23(17-8-2,18-9-3)20-21(16)19-22(4,5)6/h7-15H2,1-6H3
InChIKeyBIZHMTJCUMPSLE-UHFFFAOYSA-N
MW380.71 g/mol
LogP4.64
Rot. Bonds15

About diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane

diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane (PubChem CID 138394933) has the molecular formula C15H36O5Si3 and a molecular weight of 380.71 g/mol. Its IUPAC name is diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane.

Molecular Properties

Compound Namediethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane
PubChem CID138394933
Molecular FormulaC15H36O5Si3
Molecular Weight380.71 g/mol
Exact Mass380.19
IUPAC Namediethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane
SMILESCCCCCCCC[Si](OCC)(OCC)O[Si](=O)O[Si](C)(C)C
InChIInChI=1S/C15H36O5Si3/c1-7-10-11-12-13-14-15-23(17-8-2,18-9-3)20-21(16)19-22(4,5)6/h7-15H2,1-6H3
InChIKeyBIZHMTJCUMPSLE-UHFFFAOYSA-N
XLogP4.64
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds15
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.71
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane?
The IUPAC name of diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane (CID 138394933) is diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane.
What is the SMILES notation for diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane?
The canonical SMILES for diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane is CCCCCCCC[Si](OCC)(OCC)O[Si](=O)O[Si](C)(C)C.
What is the InChIKey of diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane?
The InChIKey is BIZHMTJCUMPSLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H36O5Si3/c1-7-10-11-12-13-14-15-23(17-8-2,18-9-3)20-21(16)19-22(4,5)6/h7-15H2,1-6H3.
What are the key properties of diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane?
diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane has a molecular weight of 380.71 g/mol, XLogP of 4.64, 15 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-octyl-[oxo(trimethylsilyloxy)silyl]oxysilane is sourced from PubChem (CID 138394933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).