triethoxy(pent-4-ynyl)silane

C11H22O3Si — CID 59533707

IUPACtriethoxy(pent-4-ynyl)silane
SMILESC#CCCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C11H22O3Si/c1-5-9-10-11-15(12-6-2,13-7-3)14-8-4/h1H,6-11H2,2-4H3
InChIKeyUERXOZNJULDFEZ-UHFFFAOYSA-N
MW230.38 g/mol
LogP2.45
Rot. Bonds9

About triethoxy(pent-4-ynyl)silane

triethoxy(pent-4-ynyl)silane (PubChem CID 59533707) has the molecular formula C11H22O3Si and a molecular weight of 230.38 g/mol. Its IUPAC name is triethoxy(pent-4-ynyl)silane.

Molecular Properties

Compound Nametriethoxy(pent-4-ynyl)silane
PubChem CID59533707
Molecular FormulaC11H22O3Si
Molecular Weight230.38 g/mol
Exact Mass230.13
IUPAC Nametriethoxy(pent-4-ynyl)silane
SMILESC#CCCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C11H22O3Si/c1-5-9-10-11-15(12-6-2,13-7-3)14-8-4/h1H,6-11H2,2-4H3
InChIKeyUERXOZNJULDFEZ-UHFFFAOYSA-N
XLogP2.45
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 triethoxy(pent-4-ynyl)silane?
The IUPAC name of triethoxy(pent-4-ynyl)silane (CID 59533707) is triethoxy(pent-4-ynyl)silane.
What is the SMILES notation for triethoxy(pent-4-ynyl)silane?
The canonical SMILES for triethoxy(pent-4-ynyl)silane is C#CCCC[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy(pent-4-ynyl)silane?
The InChIKey is UERXOZNJULDFEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3Si/c1-5-9-10-11-15(12-6-2,13-7-3)14-8-4/h1H,6-11H2,2-4H3.
What are the key properties of triethoxy(pent-4-ynyl)silane?
triethoxy(pent-4-ynyl)silane has a molecular weight of 230.38 g/mol, XLogP of 2.45, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(pent-4-ynyl)silane is sourced from PubChem (CID 59533707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).