triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane

C20H36OSi — CID 14936189

IUPACtriethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane
SMILESC=CCCCC(C#CC)(CCCC=C)O[Si](CC)(CC)CC
InChIInChI=1S/C20H36OSi/c1-7-13-15-18-20(17-9-3,19-16-14-8-2)21-22(10-4,11-5)12-6/h7-8H,1-2,10-16,18-19H2,3-6H3
InChIKeyDGBIAJLLCSUGGK-UHFFFAOYSA-N
MW320.59 g/mol
LogP6.48
Rot. Bonds13

About triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane

triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane (PubChem CID 14936189) has the molecular formula C20H36OSi and a molecular weight of 320.59 g/mol. Its IUPAC name is triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane.

Molecular Properties

Compound Nametriethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane
PubChem CID14936189
Molecular FormulaC20H36OSi
Molecular Weight320.59 g/mol
Exact Mass320.25
IUPAC Nametriethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane
SMILESC=CCCCC(C#CC)(CCCC=C)O[Si](CC)(CC)CC
InChIInChI=1S/C20H36OSi/c1-7-13-15-18-20(17-9-3,19-16-14-8-2)21-22(10-4,11-5)12-6/h7-8H,1-2,10-16,18-19H2,3-6H3
InChIKeyDGBIAJLLCSUGGK-UHFFFAOYSA-N
XLogP6.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.59
LogP ≤ 56.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane?
The IUPAC name of triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane (CID 14936189) is triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane.
What is the SMILES notation for triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane?
The canonical SMILES for triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane is C=CCCCC(C#CC)(CCCC=C)O[Si](CC)(CC)CC.
What is the InChIKey of triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane?
The InChIKey is DGBIAJLLCSUGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36OSi/c1-7-13-15-18-20(17-9-3,19-16-14-8-2)21-22(10-4,11-5)12-6/h7-8H,1-2,10-16,18-19H2,3-6H3.
What are the key properties of triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane?
triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane has a molecular weight of 320.59 g/mol, XLogP of 6.48, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane is sourced from PubChem (CID 14936189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).