[(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane

C19H36Si — CID 13168378

IUPAC[(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane
SMILESCCCCCC#CC/C=C(\CCCCCC)[Si](C)(C)C
InChIInChI=1S/C19H36Si/c1-6-8-10-12-13-14-16-18-19(20(3,4)5)17-15-11-9-7-2/h18H,6-12,15-17H2,1-5H3/b19-18+
InChIKeyKNGYJSHUASVLFH-VHEBQXMUSA-N
MW292.58 g/mol
LogP6.73
Rot. Bonds10

About [(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane

[(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane (PubChem CID 13168378) has the molecular formula C19H36Si and a molecular weight of 292.58 g/mol. Its IUPAC name is [(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane.

Molecular Properties

Compound Name[(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane
PubChem CID13168378
Molecular FormulaC19H36Si
Molecular Weight292.58 g/mol
Exact Mass292.26
IUPAC Name[(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane
SMILESCCCCCC#CC/C=C(\CCCCCC)[Si](C)(C)C
InChIInChI=1S/C19H36Si/c1-6-8-10-12-13-14-16-18-19(20(3,4)5)17-15-11-9-7-2/h18H,6-12,15-17H2,1-5H3/b19-18+
InChIKeyKNGYJSHUASVLFH-VHEBQXMUSA-N
XLogP6.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.58
LogP ≤ 56.73
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

(1-Cyclohexen-1-ylethynyl)trimethylsilane
CID 11816203
2-(Cyclohexen-1-yl)ethynyl-triethyl-silane
CID 134948291
trimethyl-[(E)-tridec-2-enyl]silane
CID 10912099
[(Z)-dodec-5-en-5-yl]-trimethylsilane
CID 12007096
trimethyl-[(E)-3-tributylstannyldec-3-en-1-ynyl]silane
CID 14660647
[(Z)-dec-3-en-3-yl]-trimethylsilane
CID 92034045
2-(Cyclohexen-1-yl)ethynyl-tri(propan-2-yl)silane
CID 101856172
triethyl-[(E)-non-2-en-2-yl]silane
CID 134975601
[(5E)-6,10-dimethylundeca-5,9-dien-1-ynyl]-trimethylsilane
CID 12489209
[(E)-dec-3-en-1,9-diynyl]-trimethylsilane
CID 135032096
[(E)-dec-3-en-1-ynyl]-trimethylsilane
CID 10932697
trimethyl-[(5E,9E,13E,17E)-6,10,14,18,22-pentamethyltricosa-5,9,13,17,21-pentaen-1-ynyl]silane
CID 11015863

Frequently Asked Questions

What is the IUPAC name of [(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane?
The IUPAC name of [(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane (CID 13168378) is [(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane.
What is the SMILES notation for [(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane?
The canonical SMILES for [(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane is CCCCCC#CC/C=C(\CCCCCC)[Si](C)(C)C.
What is the InChIKey of [(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane?
The InChIKey is KNGYJSHUASVLFH-VHEBQXMUSA-N. The full InChI is InChI=1S/C19H36Si/c1-6-8-10-12-13-14-16-18-19(20(3,4)5)17-15-11-9-7-2/h18H,6-12,15-17H2,1-5H3/b19-18+.
What are the key properties of [(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane?
[(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane has a molecular weight of 292.58 g/mol, XLogP of 6.73, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-hexadec-7-en-10-yn-7-yl]-trimethylsilane is sourced from PubChem (CID 13168378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).