[(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane

C25H48Si — CID 134982296

IUPAC[(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane
SMILESCCCCCCCCC/C=C/C=C/C(CC1CCCCC1)C[Si](C)(C)C
InChIInChI=1S/C25H48Si/c1-5-6-7-8-9-10-11-12-13-14-16-21-25(23-26(2,3)4)22-24-19-17-15-18-20-24/h13-14,16,21,24-25H,5-12,15,17-20,22-23H2,1-4H3/b14-13+,21-16+
InChIKeyZOKSMVZTQBKDSV-VXUIJSMJSA-N
MW376.75 g/mol
LogP9.16
Rot. Bonds14

About [(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane

[(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane (PubChem CID 134982296) has the molecular formula C25H48Si and a molecular weight of 376.75 g/mol. Its IUPAC name is [(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane.

Molecular Properties

Compound Name[(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane
PubChem CID134982296
Molecular FormulaC25H48Si
Molecular Weight376.75 g/mol
Exact Mass376.35
IUPAC Name[(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane
SMILESCCCCCCCCC/C=C/C=C/C(CC1CCCCC1)C[Si](C)(C)C
InChIInChI=1S/C25H48Si/c1-5-6-7-8-9-10-11-12-13-14-16-21-25(23-26(2,3)4)22-24-19-17-15-18-20-24/h13-14,16,21,24-25H,5-12,15,17-20,22-23H2,1-4H3/b14-13+,21-16+
InChIKeyZOKSMVZTQBKDSV-VXUIJSMJSA-N
XLogP9.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.75
LogP ≤ 59.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'polyene', '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
[(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)-1-cyclohexyl-3-tributylstannylprop-1-en-2-yl]-trimethylsilane
CID 11488613
[(E)-4-cyclohexylbut-2-enyl]-trimethylsilane
CID 11820449
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
trimethyl-[(E)-2-methyloctadec-7-en-7-yl]silane
CID 92042499
[(E)-4-(4-tert-butylcyclohexylidene)but-2-enyl]-trimethylsilane
CID 101077362
[(2Z)-4-cyclohexylpenta-2,4-dienyl]-trimethylsilane
CID 102012425

Frequently Asked Questions

What is the IUPAC name of [(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane?
The IUPAC name of [(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane (CID 134982296) is [(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane.
What is the SMILES notation for [(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane?
The canonical SMILES for [(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane is CCCCCCCCC/C=C/C=C/C(CC1CCCCC1)C[Si](C)(C)C.
What is the InChIKey of [(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane?
The InChIKey is ZOKSMVZTQBKDSV-VXUIJSMJSA-N. The full InChI is InChI=1S/C25H48Si/c1-5-6-7-8-9-10-11-12-13-14-16-21-25(23-26(2,3)4)22-24-19-17-15-18-20-24/h13-14,16,21,24-25H,5-12,15,17-20,22-23H2,1-4H3/b14-13+,21-16+.
What are the key properties of [(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane?
[(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane has a molecular weight of 376.75 g/mol, XLogP of 9.16, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E,5E)-2-(cyclohexylmethyl)pentadeca-3,5-dienyl]-trimethylsilane is sourced from PubChem (CID 134982296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).