[cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane

C19H36OSi — CID 131747136

IUPAC[cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane
SMILESCC[Si](CC)(CC)OC(C1CC=CCC1)C1CCCCC1
InChIInChI=1S/C19H36OSi/c1-4-21(5-2,6-3)20-19(17-13-9-7-10-14-17)18-15-11-8-12-16-18/h7,9,17-19H,4-6,8,10-16H2,1-3H3
InChIKeyGJJGJXSEZYJCNJ-UHFFFAOYSA-N
MW308.58 g/mol
LogP6.31
Rot. Bonds7

About [cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane

[cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane (PubChem CID 131747136) has the molecular formula C19H36OSi and a molecular weight of 308.58 g/mol. Its IUPAC name is [cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane.

Molecular Properties

Compound Name[cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane
PubChem CID131747136
Molecular FormulaC19H36OSi
Molecular Weight308.58 g/mol
Exact Mass308.25
IUPAC Name[cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane
SMILESCC[Si](CC)(CC)OC(C1CC=CCC1)C1CCCCC1
InChIInChI=1S/C19H36OSi/c1-4-21(5-2,6-3)20-19(17-13-9-7-10-14-17)18-15-11-8-12-16-18/h7,9,17-19H,4-6,8,10-16H2,1-3H3
InChIKeyGJJGJXSEZYJCNJ-UHFFFAOYSA-N
XLogP6.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.58
LogP ≤ 56.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 [cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane?
The IUPAC name of [cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane (CID 131747136) is [cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane.
What is the SMILES notation for [cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane?
The canonical SMILES for [cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane is CC[Si](CC)(CC)OC(C1CC=CCC1)C1CCCCC1.
What is the InChIKey of [cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane?
The InChIKey is GJJGJXSEZYJCNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36OSi/c1-4-21(5-2,6-3)20-19(17-13-9-7-10-14-17)18-15-11-8-12-16-18/h7,9,17-19H,4-6,8,10-16H2,1-3H3.
What are the key properties of [cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane?
[cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane has a molecular weight of 308.58 g/mol, XLogP of 6.31, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclohex-3-en-1-yl(cyclohexyl)methoxy]-triethylsilane is sourced from PubChem (CID 131747136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).