[(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane

C24H26Si — CID 10854822

IUPAC[(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane
SMILESC[Si](C)(C)C#C/C(=C\C#CCCCc1ccccc1)c1ccccc1
InChIInChI=1S/C24H26Si/c1-25(2,3)21-20-24(23-17-12-7-13-18-23)19-11-5-4-8-14-22-15-9-6-10-16-22/h6-7,9-10,12-13,15-19H,4,8,14H2,1-3H3/b24-19+
InChIKeyWTSXFHFUGZXKGZ-LYBHJNIJSA-N
MW342.56 g/mol
LogP5.98
Rot. Bonds4

About [(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane

[(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane (PubChem CID 10854822) has the molecular formula C24H26Si and a molecular weight of 342.56 g/mol. Its IUPAC name is [(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane
PubChem CID10854822
Molecular FormulaC24H26Si
Molecular Weight342.56 g/mol
Exact Mass342.18
IUPAC Name[(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane
SMILESC[Si](C)(C)C#C/C(=C\C#CCCCc1ccccc1)c1ccccc1
InChIInChI=1S/C24H26Si/c1-25(2,3)21-20-24(23-17-12-7-13-18-23)19-11-5-4-8-14-22-15-9-6-10-16-22/h6-7,9-10,12-13,15-19H,4,8,14H2,1-3H3/b24-19+
InChIKeyWTSXFHFUGZXKGZ-LYBHJNIJSA-N
XLogP5.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.56
LogP ≤ 55.98
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': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

trimethyl-[(E)-3-phenyloct-3-en-1-ynyl]silane
CID 71663368
[(E)-3,4-diphenylbut-3-en-1-ynyl]-trimethylsilane
CID 135024613
6-methylhept-5-en-3-ynylbenzene
CID 102338437
(3,3-dideuterio-6-phenylhex-1-ynyl)-trimethylsilane
CID 11183880
trimethyl-[(E)-5-phenyl-2-(2-trimethylsilylethynyl)pent-2-enyl]silane
CID 101105661
(3S)-2-methyl-8-phenyloct-4-yn-3-ol
CID 11991329
N-methyl-N-[[6-(5-phenylpent-1-ynyl)-2-pyridinyl]methyl]hydroxylamine
CID 154680187
8-iodooct-4-ynylbenzene
CID 139920502
triethyl(5-phenylpent-1-ynoxy)silane
CID 67428046
(3R)-1-phenyl-3-(trifluoromethyl)-6-trimethylsilylhex-5-yn-3-ol
CID 71663566
dimethyl 2-(6-phenylhex-2-ynyl)propanedioate
CID 162402811
N-[[4-chloro-6-(5-phenylpent-1-ynyl)-3-pyridinyl]methylidene]hydroxylamine
CID 142560335

Frequently Asked Questions

What is the IUPAC name of [(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane?
The IUPAC name of [(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane (CID 10854822) is [(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane.
What is the SMILES notation for [(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane?
The canonical SMILES for [(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane is C[Si](C)(C)C#C/C(=C\C#CCCCc1ccccc1)c1ccccc1.
What is the InChIKey of [(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane?
The InChIKey is WTSXFHFUGZXKGZ-LYBHJNIJSA-N. The full InChI is InChI=1S/C24H26Si/c1-25(2,3)21-20-24(23-17-12-7-13-18-23)19-11-5-4-8-14-22-15-9-6-10-16-22/h6-7,9-10,12-13,15-19H,4,8,14H2,1-3H3/b24-19+.
What are the key properties of [(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane?
[(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane has a molecular weight of 342.56 g/mol, XLogP of 5.98, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-3,9-diphenylnon-3-en-1,5-diynyl]-trimethylsilane is sourced from PubChem (CID 10854822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).