[(E)-dec-2-en-9-ynyl]-trimethylsilane

C13H24Si — CID 10584513

IUPAC[(E)-dec-2-en-9-ynyl]-trimethylsilane
SMILESC#CCCCCC/C=C/C[Si](C)(C)C
InChIInChI=1S/C13H24Si/c1-5-6-7-8-9-10-11-12-13-14(2,3)4/h1,11-12H,6-10,13H2,2-4H3/b12-11+
InChIKeyXHYAWUYWQWJLRZ-VAWYXSNFSA-N
MW208.42 g/mol
LogP4.46
Rot. Bonds7

About [(E)-dec-2-en-9-ynyl]-trimethylsilane

[(E)-dec-2-en-9-ynyl]-trimethylsilane (PubChem CID 10584513) has the molecular formula C13H24Si and a molecular weight of 208.42 g/mol. Its IUPAC name is [(E)-dec-2-en-9-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(E)-dec-2-en-9-ynyl]-trimethylsilane
PubChem CID10584513
Molecular FormulaC13H24Si
Molecular Weight208.42 g/mol
Exact Mass208.16
IUPAC Name[(E)-dec-2-en-9-ynyl]-trimethylsilane
SMILESC#CCCCCC/C=C/C[Si](C)(C)C
InChIInChI=1S/C13H24Si/c1-5-6-7-8-9-10-11-12-13-14(2,3)4/h1,11-12H,6-10,13H2,2-4H3/b12-11+
InChIKeyXHYAWUYWQWJLRZ-VAWYXSNFSA-N
XLogP4.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.42
LogP ≤ 54.46
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': '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 [(E)-dec-2-en-9-ynyl]-trimethylsilane?
The IUPAC name of [(E)-dec-2-en-9-ynyl]-trimethylsilane (CID 10584513) is [(E)-dec-2-en-9-ynyl]-trimethylsilane.
What is the SMILES notation for [(E)-dec-2-en-9-ynyl]-trimethylsilane?
The canonical SMILES for [(E)-dec-2-en-9-ynyl]-trimethylsilane is C#CCCCCC/C=C/C[Si](C)(C)C.
What is the InChIKey of [(E)-dec-2-en-9-ynyl]-trimethylsilane?
The InChIKey is XHYAWUYWQWJLRZ-VAWYXSNFSA-N. The full InChI is InChI=1S/C13H24Si/c1-5-6-7-8-9-10-11-12-13-14(2,3)4/h1,11-12H,6-10,13H2,2-4H3/b12-11+.
What are the key properties of [(E)-dec-2-en-9-ynyl]-trimethylsilane?
[(E)-dec-2-en-9-ynyl]-trimethylsilane has a molecular weight of 208.42 g/mol, XLogP of 4.46, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-dec-2-en-9-ynyl]-trimethylsilane is sourced from PubChem (CID 10584513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).