dimethyl-(2-methylbutoxy)-octoxysilane

C15H34O2Si — CID 91739174

IUPACdimethyl-(2-methylbutoxy)-octoxysilane
SMILESCCCCCCCCO[Si](C)(C)OCC(C)CC
InChIInChI=1S/C15H34O2Si/c1-6-8-9-10-11-12-13-16-18(4,5)17-14-15(3)7-2/h15H,6-14H2,1-5H3
InChIKeyVJDWKVCUEQXYGM-UHFFFAOYSA-N
MW274.52 g/mol
LogP5.13
Rot. Bonds12

About dimethyl-(2-methylbutoxy)-octoxysilane

dimethyl-(2-methylbutoxy)-octoxysilane (PubChem CID 91739174) has the molecular formula C15H34O2Si and a molecular weight of 274.52 g/mol. Its IUPAC name is dimethyl-(2-methylbutoxy)-octoxysilane.

Molecular Properties

Compound Namedimethyl-(2-methylbutoxy)-octoxysilane
PubChem CID91739174
Molecular FormulaC15H34O2Si
Molecular Weight274.52 g/mol
Exact Mass274.23
IUPAC Namedimethyl-(2-methylbutoxy)-octoxysilane
SMILESCCCCCCCCO[Si](C)(C)OCC(C)CC
InChIInChI=1S/C15H34O2Si/c1-6-8-9-10-11-12-13-16-18(4,5)17-14-15(3)7-2/h15H,6-14H2,1-5H3
InChIKeyVJDWKVCUEQXYGM-UHFFFAOYSA-N
XLogP5.13
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.52
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 dimethyl-(2-methylbutoxy)-octoxysilane?
The IUPAC name of dimethyl-(2-methylbutoxy)-octoxysilane (CID 91739174) is dimethyl-(2-methylbutoxy)-octoxysilane.
What is the SMILES notation for dimethyl-(2-methylbutoxy)-octoxysilane?
The canonical SMILES for dimethyl-(2-methylbutoxy)-octoxysilane is CCCCCCCCO[Si](C)(C)OCC(C)CC.
What is the InChIKey of dimethyl-(2-methylbutoxy)-octoxysilane?
The InChIKey is VJDWKVCUEQXYGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34O2Si/c1-6-8-9-10-11-12-13-16-18(4,5)17-14-15(3)7-2/h15H,6-14H2,1-5H3.
What are the key properties of dimethyl-(2-methylbutoxy)-octoxysilane?
dimethyl-(2-methylbutoxy)-octoxysilane has a molecular weight of 274.52 g/mol, XLogP of 5.13, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(2-methylbutoxy)-octoxysilane is sourced from PubChem (CID 91739174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).