[3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane

C32H44Si2 — CID 135046217

IUPAC[3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane
SMILESCC(C)=C(C#CC(C#C[Si](C)(C)C)=C1CCCCC1)C#CC(C#C[Si](C)(C)C)=C1CCCCC1
InChIInChI=1S/C32H44Si2/c1-27(2)28(19-21-31(23-25-33(3,4)5)29-15-11-9-12-16-29)20-22-32(24-26-34(6,7)8)30-17-13-10-14-18-30/h9-18H2,1-8H3
InChIKeyNHXQIRNGJCURJH-UHFFFAOYSA-N
MW484.88 g/mol
LogP8.61
Rot. Bonds

About [3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane

[3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane (PubChem CID 135046217) has the molecular formula C32H44Si2 and a molecular weight of 484.88 g/mol. Its IUPAC name is [3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane.

Molecular Properties

Compound Name[3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane
PubChem CID135046217
Molecular FormulaC32H44Si2
Molecular Weight484.88 g/mol
Exact Mass484.30
IUPAC Name[3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane
SMILESCC(C)=C(C#CC(C#C[Si](C)(C)C)=C1CCCCC1)C#CC(C#C[Si](C)(C)C)=C1CCCCC1
InChIInChI=1S/C32H44Si2/c1-27(2)28(19-21-31(23-25-33(3,4)5)29-15-11-9-12-16-29)20-22-32(24-26-34(6,7)8)30-17-13-10-14-18-30/h9-18H2,1-8H3
InChIKeyNHXQIRNGJCURJH-UHFFFAOYSA-N
XLogP8.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500484.88
LogP ≤ 58.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[3-[4-[1,5-Bis(trimethylsilyl)penta-1,4-diyn-3-ylidene]cyclohexylidene]-5-trimethylsilylpenta-1,4-diynyl]-trimethylsilane
CID 15363827
[6,12-Di(cyclohexylidene)-16-methyl-3,9-di(propan-2-ylidene)-15-(2-trimethylsilylethynyl)heptadec-15-en-1,4,7,10,13-pentaynyl]-trimethylsilane
CID 134901393
trimethyl-[2-[(1Z,5Z)-2,5,6-tris(2-trimethylsilylethynyl)cycloocta-1,5-dien-1-yl]ethynyl]silane
CID 15266021
(3-Cyclohexylidene-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane
CID 10684806
Tert-butyl-(3-cyclohexylidenepenta-1,4-diynyl)-dimethylsilane
CID 11708690
[(E)-3,4-dicyclohexyl-6-tri(propan-2-yl)silylhex-3-en-1,5-diynyl]-tri(propan-2-yl)silane
CID 11827786
[3-[4-[1,5-Bis[tri(propan-2-yl)silyl]penta-1,4-diyn-3-ylidene]cyclohexylidene]-5-tri(propan-2-yl)silylpenta-1,4-diynyl]-tri(propan-2-yl)silane
CID 15363828
7,7-Ditert-butyl-8-[2-(7,7-ditert-butyl-7-silabicyclo[4.2.0]oct-1(8)-en-8-yl)ethynyl]-7-silabicyclo[4.2.0]oct-1(8)-ene
CID 15534917
[3,4-Dicyclohexyl-6-tri(propan-2-yl)silylhex-3-en-1,5-diynyl]-tri(propan-2-yl)silane
CID 57373168
[(Z)-3,4-dicyclohexyl-6-tri(propan-2-yl)silylhex-3-en-1,5-diynyl]-tri(propan-2-yl)silane
CID 100967830
Tri(propan-2-yl)-[3,8,13-tri(cyclohexylidene)-15-tri(propan-2-yl)silylpentadeca-1,4,6,9,11,14-hexaynyl]silane
CID 101194212
[3,8-Di(cyclohexylidene)-10-tri(propan-2-yl)silyldeca-1,4,6,9-tetraynyl]-tri(propan-2-yl)silane
CID 101194213

Frequently Asked Questions

What is the IUPAC name of [3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane?
The IUPAC name of [3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane (CID 135046217) is [3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane.
What is the SMILES notation for [3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane?
The canonical SMILES for [3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane is CC(C)=C(C#CC(C#C[Si](C)(C)C)=C1CCCCC1)C#CC(C#C[Si](C)(C)C)=C1CCCCC1.
What is the InChIKey of [3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane?
The InChIKey is NHXQIRNGJCURJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H44Si2/c1-27(2)28(19-21-31(23-25-33(3,4)5)29-15-11-9-12-16-29)20-22-32(24-26-34(6,7)8)30-17-13-10-14-18-30/h9-18H2,1-8H3.
What are the key properties of [3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane?
[3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane has a molecular weight of 484.88 g/mol, XLogP of 8.61, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [3,9-di(cyclohexylidene)-6-propan-2-ylidene-11-trimethylsilylundeca-1,4,7,10-tetraynyl]-trimethylsilane is sourced from PubChem (CID 135046217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).