2-cyclohex-3-en-1-ylethyl(triethoxy)silane

C14H28O3Si — CID 11300254

IUPAC2-cyclohex-3-en-1-ylethyl(triethoxy)silane
SMILESCCO[Si](CCC1CC=CCC1)(OCC)OCC
InChIInChI=1S/C14H28O3Si/c1-4-15-18(16-5-2,17-6-3)13-12-14-10-8-7-9-11-14/h7-8,14H,4-6,9-13H2,1-3H3
InChIKeyAOFBJTGHSYNINY-UHFFFAOYSA-N
MW272.46 g/mol
LogP3.78
Rot. Bonds9

About 2-cyclohex-3-en-1-ylethyl(triethoxy)silane

2-cyclohex-3-en-1-ylethyl(triethoxy)silane (PubChem CID 11300254) has the molecular formula C14H28O3Si and a molecular weight of 272.46 g/mol. Its IUPAC name is 2-cyclohex-3-en-1-ylethyl(triethoxy)silane.

Molecular Properties

Compound Name2-cyclohex-3-en-1-ylethyl(triethoxy)silane
PubChem CID11300254
Molecular FormulaC14H28O3Si
Molecular Weight272.46 g/mol
Exact Mass272.18
IUPAC Name2-cyclohex-3-en-1-ylethyl(triethoxy)silane
SMILESCCO[Si](CCC1CC=CCC1)(OCC)OCC
InChIInChI=1S/C14H28O3Si/c1-4-15-18(16-5-2,17-6-3)13-12-14-10-8-7-9-11-14/h7-8,14H,4-6,9-13H2,1-3H3
InChIKeyAOFBJTGHSYNINY-UHFFFAOYSA-N
XLogP3.78
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohex-3-en-1-ylethyl(triethoxy)silane?
The IUPAC name of 2-cyclohex-3-en-1-ylethyl(triethoxy)silane (CID 11300254) is 2-cyclohex-3-en-1-ylethyl(triethoxy)silane.
What is the SMILES notation for 2-cyclohex-3-en-1-ylethyl(triethoxy)silane?
The canonical SMILES for 2-cyclohex-3-en-1-ylethyl(triethoxy)silane is CCO[Si](CCC1CC=CCC1)(OCC)OCC.
What is the InChIKey of 2-cyclohex-3-en-1-ylethyl(triethoxy)silane?
The InChIKey is AOFBJTGHSYNINY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O3Si/c1-4-15-18(16-5-2,17-6-3)13-12-14-10-8-7-9-11-14/h7-8,14H,4-6,9-13H2,1-3H3.
What are the key properties of 2-cyclohex-3-en-1-ylethyl(triethoxy)silane?
2-cyclohex-3-en-1-ylethyl(triethoxy)silane has a molecular weight of 272.46 g/mol, XLogP of 3.78, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohex-3-en-1-ylethyl(triethoxy)silane is sourced from PubChem (CID 11300254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).