[(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane

C18H30Si — CID 11033074

IUPAC[(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane
SMILESC=CCC(/C=C(/C)C#C[Si](C)(C)C)C1CCCCC1
InChIInChI=1S/C18H30Si/c1-6-10-18(17-11-8-7-9-12-17)15-16(2)13-14-19(3,4)5/h6,15,17-18H,1,7-12H2,2-5H3/b16-15-
InChIKeyOZPCZURYRXHJRH-NXVVXOECSA-N
MW274.52 g/mol
LogP5.59
Rot. Bonds4

About [(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane

[(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane (PubChem CID 11033074) has the molecular formula C18H30Si and a molecular weight of 274.52 g/mol. Its IUPAC name is [(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane
PubChem CID11033074
Molecular FormulaC18H30Si
Molecular Weight274.52 g/mol
Exact Mass274.21
IUPAC Name[(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane
SMILESC=CCC(/C=C(/C)C#C[Si](C)(C)C)C1CCCCC1
InChIInChI=1S/C18H30Si/c1-6-10-18(17-11-8-7-9-12-17)15-16(2)13-14-19(3,4)5/h6,15,17-18H,1,7-12H2,2-5H3/b16-15-
InChIKeyOZPCZURYRXHJRH-NXVVXOECSA-N
XLogP5.59
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 ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane?
The IUPAC name of [(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane (CID 11033074) is [(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane?
The canonical SMILES for [(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane is C=CCC(/C=C(/C)C#C[Si](C)(C)C)C1CCCCC1.
What is the InChIKey of [(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane?
The InChIKey is OZPCZURYRXHJRH-NXVVXOECSA-N. The full InChI is InChI=1S/C18H30Si/c1-6-10-18(17-11-8-7-9-12-17)15-16(2)13-14-19(3,4)5/h6,15,17-18H,1,7-12H2,2-5H3/b16-15-.
What are the key properties of [(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane?
[(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane has a molecular weight of 274.52 g/mol, XLogP of 5.59, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3Z)-5-cyclohexyl-3-methylocta-3,7-dien-1-ynyl]-trimethylsilane is sourced from PubChem (CID 11033074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).