[(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane

C9H16OSi — CID 134890655

IUPAC[(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane
SMILESCO/C=C/CC#C[Si](C)(C)C
InChIInChI=1S/C9H16OSi/c1-10-8-6-5-7-9-11(2,3)4/h6,8H,5H2,1-4H3/b8-6+
InChIKeyPWQJAFDNBRQZEN-SOFGYWHQSA-N
MW168.31 g/mol
LogP2.42
Rot. Bonds2

About [(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane

[(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane (PubChem CID 134890655) has the molecular formula C9H16OSi and a molecular weight of 168.31 g/mol. Its IUPAC name is [(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane
PubChem CID134890655
Molecular FormulaC9H16OSi
Molecular Weight168.31 g/mol
Exact Mass168.10
IUPAC Name[(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane
SMILESCO/C=C/CC#C[Si](C)(C)C
InChIInChI=1S/C9H16OSi/c1-10-8-6-5-7-9-11(2,3)4/h6,8H,5H2,1-4H3/b8-6+
InChIKeyPWQJAFDNBRQZEN-SOFGYWHQSA-N
XLogP2.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.31
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane?
The IUPAC name of [(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane (CID 134890655) is [(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane?
The canonical SMILES for [(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane is CO/C=C/CC#C[Si](C)(C)C.
What is the InChIKey of [(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane?
The InChIKey is PWQJAFDNBRQZEN-SOFGYWHQSA-N. The full InChI is InChI=1S/C9H16OSi/c1-10-8-6-5-7-9-11(2,3)4/h6,8H,5H2,1-4H3/b8-6+.
What are the key properties of [(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane?
[(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane has a molecular weight of 168.31 g/mol, XLogP of 2.42, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-5-methoxypent-4-en-1-ynyl]-trimethylsilane is sourced from PubChem (CID 134890655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).