[(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane

C14H24OSi — CID 22962113

IUPAC[(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane
SMILESCCOC/C=C/C/C=C/CC#C[Si](C)(C)C
InChIInChI=1S/C14H24OSi/c1-5-15-13-11-9-7-6-8-10-12-14-16(2,3)4/h6,8-9,11H,5,7,10,13H2,1-4H3/b8-6+,11-9+
InChIKeyYCZYWWJVAWUQCD-ZOIFJEAISA-N
MW236.43 g/mol
LogP3.80
Rot. Bonds6

About [(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane

[(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane (PubChem CID 22962113) has the molecular formula C14H24OSi and a molecular weight of 236.43 g/mol. Its IUPAC name is [(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane
PubChem CID22962113
Molecular FormulaC14H24OSi
Molecular Weight236.43 g/mol
Exact Mass236.16
IUPAC Name[(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane
SMILESCCOC/C=C/C/C=C/CC#C[Si](C)(C)C
InChIInChI=1S/C14H24OSi/c1-5-15-13-11-9-7-6-8-10-12-14-16(2,3)4/h6,8-9,11H,5,7,10,13H2,1-4H3/b8-6+,11-9+
InChIKeyYCZYWWJVAWUQCD-ZOIFJEAISA-N
XLogP3.80
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.43
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 [(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane?
The IUPAC name of [(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane (CID 22962113) is [(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane?
The canonical SMILES for [(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane is CCOC/C=C/C/C=C/CC#C[Si](C)(C)C.
What is the InChIKey of [(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane?
The InChIKey is YCZYWWJVAWUQCD-ZOIFJEAISA-N. The full InChI is InChI=1S/C14H24OSi/c1-5-15-13-11-9-7-6-8-10-12-14-16(2,3)4/h6,8-9,11H,5,7,10,13H2,1-4H3/b8-6+,11-9+.
What are the key properties of [(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane?
[(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane has a molecular weight of 236.43 g/mol, XLogP of 3.80, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(4E,7E)-9-ethoxynona-4,7-dien-1-ynyl]-trimethylsilane is sourced from PubChem (CID 22962113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).