trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane

C16H28Si — CID 101267049

IUPACtrimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane
SMILESCCCCCC/C=C(C)\C=C\C#C[Si](C)(C)C
InChIInChI=1S/C16H28Si/c1-6-7-8-9-10-13-16(2)14-11-12-15-17(3,4)5/h11,13-14H,6-10H2,1-5H3/b14-11+,16-13-
InChIKeyYBHVHPINPLGMHS-YLJYFMQQSA-N
MW248.49 g/mol
LogP5.34
Rot. Bonds6

About trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane

trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane (PubChem CID 101267049) has the molecular formula C16H28Si and a molecular weight of 248.49 g/mol. Its IUPAC name is trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane
PubChem CID101267049
Molecular FormulaC16H28Si
Molecular Weight248.49 g/mol
Exact Mass248.20
IUPAC Nametrimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane
SMILESCCCCCC/C=C(C)\C=C\C#C[Si](C)(C)C
InChIInChI=1S/C16H28Si/c1-6-7-8-9-10-13-16(2)14-11-12-15-17(3,4)5/h11,13-14H,6-10H2,1-5H3/b14-11+,16-13-
InChIKeyYBHVHPINPLGMHS-YLJYFMQQSA-N
XLogP5.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500248.49
LogP ≤ 55.34
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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane with MolForge

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Related Compounds

(1-Cyclohexen-1-ylethynyl)trimethylsilane
CID 11816203
2-(Cyclohexen-1-yl)ethynyl-triethyl-silane
CID 134948291
[(E)-3-cyclohexylideneprop-1-enyl]-trimethylsilane
CID 10081354
[(E)-2-(cyclohexen-1-yl)ethenyl]-trimethylsilane
CID 14175461
[(E)-2-(cyclopenten-1-yl)ethenyl]-trimethylsilane
CID 14175462
2-(Cyclohexen-1-yl)ethynyl-tri(propan-2-yl)silane
CID 101856172
[(E)-dec-3-en-1-ynyl]-trimethylsilane
CID 10932697
[(E)-cyclohex-2-en-1-ylidenemethyl]-trimethylsilane
CID 11030206
trimethyl-[(2E)-5-pentyldeca-2,4-dienyl]silane
CID 11196759
[(3E,5Z,7E)-6-bromo-8-(cyclohexen-1-yl)octa-3,5,7-trien-1-ynyl]-trimethylsilane
CID 11302098
[(Z)-dec-3-en-1-ynyl]-trimethylsilane
CID 11401535
[(3E,5E,7E)-8-(cyclohexen-1-yl)-6-methylocta-3,5,7-trien-1-ynyl]-trimethylsilane
CID 11425713

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane?
The IUPAC name of trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane (CID 101267049) is trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane.
What is the SMILES notation for trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane?
The canonical SMILES for trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane is CCCCCC/C=C(C)\C=C\C#C[Si](C)(C)C.
What is the InChIKey of trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane?
The InChIKey is YBHVHPINPLGMHS-YLJYFMQQSA-N. The full InChI is InChI=1S/C16H28Si/c1-6-7-8-9-10-13-16(2)14-11-12-15-17(3,4)5/h11,13-14H,6-10H2,1-5H3/b14-11+,16-13-.
What are the key properties of trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane?
trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane has a molecular weight of 248.49 g/mol, XLogP of 5.34, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(3E,5Z)-5-methyldodeca-3,5-dien-1-ynyl]silane is sourced from PubChem (CID 101267049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).