[(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane

C14H22OSi — CID 102095717

IUPAC[(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane
SMILESC=CC1COC/C1=C(/C#C[Si](C)(C)C)CC
InChIInChI=1S/C14H22OSi/c1-6-12(8-9-16(3,4)5)14-11-15-10-13(14)7-2/h7,13H,2,6,10-11H2,1,3-5H3/b14-12-
InChIKeyZVJKSBUIATVUDR-OWBHPGMISA-N
MW234.41 g/mol
LogP3.41
Rot. Bonds2

About [(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane

[(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane (PubChem CID 102095717) has the molecular formula C14H22OSi and a molecular weight of 234.41 g/mol. Its IUPAC name is [(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane.

Molecular Properties

Compound Name[(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane
PubChem CID102095717
Molecular FormulaC14H22OSi
Molecular Weight234.41 g/mol
Exact Mass234.14
IUPAC Name[(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane
SMILESC=CC1COC/C1=C(/C#C[Si](C)(C)C)CC
InChIInChI=1S/C14H22OSi/c1-6-12(8-9-16(3,4)5)14-11-15-10-13(14)7-2/h7,13H,2,6,10-11H2,1,3-5H3/b14-12-
InChIKeyZVJKSBUIATVUDR-OWBHPGMISA-N
XLogP3.41
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.41
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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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Related Compounds

3,3a,6,7-tetrahydro-1H-cyclohepta[c]furan-8-yl(trimethyl)silane
CID 11063663
[(5R,8aS)-3,5,6,8a-tetrahydro-1H-cyclohepta[c]furan-5-yl]-trimethylsilane
CID 101350509
[(5R,8aS)-4-methyl-3,5,6,8a-tetrahydro-1H-cyclohepta[c]furan-5-yl]-trimethylsilane
CID 101350510
[(5R,6R,8aS)-6-methyl-3,5,6,8a-tetrahydro-1H-cyclohepta[c]furan-5-yl]-trimethylsilane
CID 101350511
[(5R,6R,8aS)-4,6-dimethyl-3,5,6,8a-tetrahydro-1H-cyclohepta[c]furan-5-yl]-trimethylsilane
CID 101350512
[(5R,7aS)-5-methyl-1,3,5,7a-tetrahydro-2-benzofuran-4-yl]methoxy-tert-butyl-dimethylsilane
CID 134900317
2-(3,6-dihydro-2H-pyran-4-yl)ethynyl-trimethylsilane
CID 68606666
[(7aS)-6-methyl-1,3,5,7a-tetrahydro-2-benzofuran-4-yl]-trimethylsilane
CID 11095845
[(5R,7aS)-5-methyl-1,3,5,7a-tetrahydro-2-benzofuran-4-yl]-trimethylsilane
CID 11401534
[(3aS)-3,3a,6,7-tetrahydro-1H-cyclohepta[c]furan-8-yl]-trimethylsilane
CID 101077407
[(5S,8aR)-3,5,6,8a-tetrahydro-1H-cyclohepta[c]furan-5-yl]-trimethylsilane
CID 101399596
[(5S,6R,8aR)-4,6-dimethyl-3,5,6,8a-tetrahydro-1H-cyclohepta[c]furan-5-yl]-trimethylsilane
CID 101399598

Frequently Asked Questions

What is the IUPAC name of [(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane?
The IUPAC name of [(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane (CID 102095717) is [(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane.
What is the SMILES notation for [(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane?
The canonical SMILES for [(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane is C=CC1COC/C1=C(/C#C[Si](C)(C)C)CC.
What is the InChIKey of [(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane?
The InChIKey is ZVJKSBUIATVUDR-OWBHPGMISA-N. The full InChI is InChI=1S/C14H22OSi/c1-6-12(8-9-16(3,4)5)14-11-15-10-13(14)7-2/h7,13H,2,6,10-11H2,1,3-5H3/b14-12-.
What are the key properties of [(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane?
[(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane has a molecular weight of 234.41 g/mol, XLogP of 3.41, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(3E)-3-(4-ethenyloxolan-3-ylidene)pent-1-ynyl]-trimethylsilane is sourced from PubChem (CID 102095717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).