triethyl(5-methylideneoct-1-yn-4-yloxy)silane

C15H28OSi — CID 12786182

IUPACtriethyl(5-methylideneoct-1-yn-4-yloxy)silane
SMILESC#CCC(O[Si](CC)(CC)CC)C(=C)CCC
InChIInChI=1S/C15H28OSi/c1-7-12-14(6)15(13-8-2)16-17(9-3,10-4)11-5/h2,15H,6-7,9-13H2,1,3-5H3
InChIKeyPOMJJMAQXVZWFA-UHFFFAOYSA-N
MW252.47 g/mol
LogP4.76
Rot. Bonds9

About triethyl(5-methylideneoct-1-yn-4-yloxy)silane

triethyl(5-methylideneoct-1-yn-4-yloxy)silane (PubChem CID 12786182) has the molecular formula C15H28OSi and a molecular weight of 252.47 g/mol. Its IUPAC name is triethyl(5-methylideneoct-1-yn-4-yloxy)silane.

Molecular Properties

Compound Nametriethyl(5-methylideneoct-1-yn-4-yloxy)silane
PubChem CID12786182
Molecular FormulaC15H28OSi
Molecular Weight252.47 g/mol
Exact Mass252.19
IUPAC Nametriethyl(5-methylideneoct-1-yn-4-yloxy)silane
SMILESC#CCC(O[Si](CC)(CC)CC)C(=C)CCC
InChIInChI=1S/C15H28OSi/c1-7-12-14(6)15(13-8-2)16-17(9-3,10-4)11-5/h2,15H,6-7,9-13H2,1,3-5H3
InChIKeyPOMJJMAQXVZWFA-UHFFFAOYSA-N
XLogP4.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.47
LogP ≤ 54.76
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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Frequently Asked Questions

What is the IUPAC name of triethyl(5-methylideneoct-1-yn-4-yloxy)silane?
The IUPAC name of triethyl(5-methylideneoct-1-yn-4-yloxy)silane (CID 12786182) is triethyl(5-methylideneoct-1-yn-4-yloxy)silane.
What is the SMILES notation for triethyl(5-methylideneoct-1-yn-4-yloxy)silane?
The canonical SMILES for triethyl(5-methylideneoct-1-yn-4-yloxy)silane is C#CCC(O[Si](CC)(CC)CC)C(=C)CCC.
What is the InChIKey of triethyl(5-methylideneoct-1-yn-4-yloxy)silane?
The InChIKey is POMJJMAQXVZWFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28OSi/c1-7-12-14(6)15(13-8-2)16-17(9-3,10-4)11-5/h2,15H,6-7,9-13H2,1,3-5H3.
What are the key properties of triethyl(5-methylideneoct-1-yn-4-yloxy)silane?
triethyl(5-methylideneoct-1-yn-4-yloxy)silane has a molecular weight of 252.47 g/mol, XLogP of 4.76, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(5-methylideneoct-1-yn-4-yloxy)silane is sourced from PubChem (CID 12786182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).