2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane

C18H34O3Si — CID 66694493

IUPAC2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane
SMILESC=CC1CCCCC1(C=C)CC[Si](OCC)(OCC)OCC
InChIInChI=1S/C18H34O3Si/c1-6-17-13-11-12-14-18(17,7-2)15-16-22(19-8-3,20-9-4)21-10-5/h6-7,17H,1-2,8-16H2,3-5H3
InChIKeySVYZIBRNKRCZCB-UHFFFAOYSA-N
MW326.55 g/mol
LogP4.97
Rot. Bonds11

About 2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane

2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane (PubChem CID 66694493) has the molecular formula C18H34O3Si and a molecular weight of 326.55 g/mol. Its IUPAC name is 2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane.

Molecular Properties

Compound Name2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane
PubChem CID66694493
Molecular FormulaC18H34O3Si
Molecular Weight326.55 g/mol
Exact Mass326.23
IUPAC Name2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane
SMILESC=CC1CCCCC1(C=C)CC[Si](OCC)(OCC)OCC
InChIInChI=1S/C18H34O3Si/c1-6-17-13-11-12-14-18(17,7-2)15-16-22(19-8-3,20-9-4)21-10-5/h6-7,17H,1-2,8-16H2,3-5H3
InChIKeySVYZIBRNKRCZCB-UHFFFAOYSA-N
XLogP4.97
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.55
LogP ≤ 54.97
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-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane?
The IUPAC name of 2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane (CID 66694493) is 2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane.
What is the SMILES notation for 2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane?
The canonical SMILES for 2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane is C=CC1CCCCC1(C=C)CC[Si](OCC)(OCC)OCC.
What is the InChIKey of 2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane?
The InChIKey is SVYZIBRNKRCZCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O3Si/c1-6-17-13-11-12-14-18(17,7-2)15-16-22(19-8-3,20-9-4)21-10-5/h6-7,17H,1-2,8-16H2,3-5H3.
What are the key properties of 2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane?
2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane has a molecular weight of 326.55 g/mol, XLogP of 4.97, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1,2-bis(ethenyl)cyclohexyl]ethyl-triethoxysilane is sourced from PubChem (CID 66694493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).