[5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane

C18H30Si — CID 172555604

IUPAC[5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane
SMILESC[Si](C)(C)C1=CC=CC(=CCCC2CCCCC2)C1
InChIInChI=1S/C18H30Si/c1-19(2,3)18-14-8-13-17(15-18)12-7-11-16-9-5-4-6-10-16/h8,12-14,16H,4-7,9-11,15H2,1-3H3
InChIKeyQSJLQJNFSQYFPF-UHFFFAOYSA-N
MW274.52 g/mol
LogP6.04
Rot. Bonds4

About [5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane

[5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane (PubChem CID 172555604) has the molecular formula C18H30Si and a molecular weight of 274.52 g/mol. Its IUPAC name is [5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane.

Molecular Properties

Compound Name[5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane
PubChem CID172555604
Molecular FormulaC18H30Si
Molecular Weight274.52 g/mol
Exact Mass274.21
IUPAC Name[5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane
SMILESC[Si](C)(C)C1=CC=CC(=CCCC2CCCCC2)C1
InChIInChI=1S/C18H30Si/c1-19(2,3)18-14-8-13-17(15-18)12-7-11-16-9-5-4-6-10-16/h8,12-14,16H,4-7,9-11,15H2,1-3H3
InChIKeyQSJLQJNFSQYFPF-UHFFFAOYSA-N
XLogP6.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.52
LogP ≤ 56.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[(E)-3-cyclohexylprop-2-enyl]-trimethylsilane
CID 11252579
[(Z)-3-cyclohexylprop-2-enyl]-trimethylsilane
CID 13215154
[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydronaphthalen-1-yl]-trimethylsilane
CID 134993439
1,2,3,4-tetra(cyclohexa-2,4-dien-1-yl)-1H-silole
CID 123399072
[(2E)-4-cyclohexylpenta-2,4-dienyl]-trimethylsilane
CID 11229798
[(6E)-8-cyclohexylocta-1,6-dien-3-yl]-triethylsilane
CID 11460962
trimethyl-[(1E,3E)-4-(2,6,6-trimethylcyclohexen-1-yl)buta-1,3-dienyl]silane
CID 11470674
[(E)-4-cyclohexylbut-2-enyl]-trimethylsilane
CID 11820449
[(Z)-(3,5-dimethylcyclohex-2-en-1-ylidene)methyl]-trimethylsilane
CID 15040722
trimethyl-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienyl]silane
CID 15143647
[(E)-1-cyclohexyloct-1-en-3-yl]-trimethylsilane
CID 16732184
[(Z)-3-cyclohexyl-2-methylprop-2-enyl]-trimethylsilane
CID 21726122

Frequently Asked Questions

What is the IUPAC name of [5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane?
The IUPAC name of [5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane (CID 172555604) is [5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane.
What is the SMILES notation for [5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane?
The canonical SMILES for [5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane is C[Si](C)(C)C1=CC=CC(=CCCC2CCCCC2)C1.
What is the InChIKey of [5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane?
The InChIKey is QSJLQJNFSQYFPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30Si/c1-19(2,3)18-14-8-13-17(15-18)12-7-11-16-9-5-4-6-10-16/h8,12-14,16H,4-7,9-11,15H2,1-3H3.
What are the key properties of [5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane?
[5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane has a molecular weight of 274.52 g/mol, XLogP of 6.04, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-cyclohexylpropylidene)cyclohexa-1,3-dien-1-yl]-trimethylsilane is sourced from PubChem (CID 172555604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).