[(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane

C15H26Si — CID 11458981

IUPAC[(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane
SMILESCCCCCC/C=C/C=C/C#C[Si](C)(C)C
InChIInChI=1S/C15H26Si/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4/h10-13H,5-9H2,1-4H3/b11-10+,13-12+
InChIKeyJOYAFJIPYDMPKB-AQASXUMVSA-N
MW234.46 g/mol
LogP4.95
Rot. Bonds6

About [(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane

[(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane (PubChem CID 11458981) has the molecular formula C15H26Si and a molecular weight of 234.46 g/mol. Its IUPAC name is [(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane
PubChem CID11458981
Molecular FormulaC15H26Si
Molecular Weight234.46 g/mol
Exact Mass234.18
IUPAC Name[(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane
SMILESCCCCCC/C=C/C=C/C#C[Si](C)(C)C
InChIInChI=1S/C15H26Si/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4/h10-13H,5-9H2,1-4H3/b11-10+,13-12+
InChIKeyJOYAFJIPYDMPKB-AQASXUMVSA-N
XLogP4.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.46
LogP ≤ 54.95
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'}

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Related Compounds

(E)-1-(Trimethylsilyl)-3-hepten-1-yne
CID 10559007
trimethyl-[(4Z)-undeca-1,4-dien-4-yl]silane
CID 10900278
trimethyl-[(Z)-non-2-enyl]silane
CID 12507242
trimethyl-[(E)-oct-3-en-1-ynyl]silane
CID 13679641
[(E)-dec-2-enyl]-trimethylsilane
CID 13776256
[(E)-2-(cyclohexen-1-yl)ethenyl]-trimethylsilane
CID 14175461
[(Z)-dec-3-en-3-yl]-trimethylsilane
CID 92034045
[(1E,3E)-hepta-1,3-dienyl]-trimethylsilane
CID 12494006
1-Triethylsilyl-2-octene
CID 131735857
[(E)-dec-3-en-1,9-diynyl]-trimethylsilane
CID 135032096
trimethyl-[(E)-oct-2-enyl]silane
CID 10910229
[(E)-dec-3-en-1-ynyl]-trimethylsilane
CID 10932697

Frequently Asked Questions

What is the IUPAC name of [(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane?
The IUPAC name of [(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane (CID 11458981) is [(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane?
The canonical SMILES for [(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane is CCCCCC/C=C/C=C/C#C[Si](C)(C)C.
What is the InChIKey of [(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane?
The InChIKey is JOYAFJIPYDMPKB-AQASXUMVSA-N. The full InChI is InChI=1S/C15H26Si/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4/h10-13H,5-9H2,1-4H3/b11-10+,13-12+.
What are the key properties of [(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane?
[(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane has a molecular weight of 234.46 g/mol, XLogP of 4.95, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E,5E)-dodeca-3,5-dien-1-ynyl]-trimethylsilane is sourced from PubChem (CID 11458981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).