1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane

C13H28O3Si — CID 84820357

IUPAC1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane
SMILESCCCC(C=C(OCC)OCC)O[Si](C)(C)C
InChIInChI=1S/C13H28O3Si/c1-7-10-12(16-17(4,5)6)11-13(14-8-2)15-9-3/h11-12H,7-10H2,1-6H3
InChIKeyQMXKYZKYWPICPB-UHFFFAOYSA-N
MW260.45 g/mol
LogP3.92
Rot. Bonds9

About 1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane

1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane (PubChem CID 84820357) has the molecular formula C13H28O3Si and a molecular weight of 260.45 g/mol. Its IUPAC name is 1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane.

Molecular Properties

Compound Name1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane
PubChem CID84820357
Molecular FormulaC13H28O3Si
Molecular Weight260.45 g/mol
Exact Mass260.18
IUPAC Name1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane
SMILESCCCC(C=C(OCC)OCC)O[Si](C)(C)C
InChIInChI=1S/C13H28O3Si/c1-7-10-12(16-17(4,5)6)11-13(14-8-2)15-9-3/h11-12H,7-10H2,1-6H3
InChIKeyQMXKYZKYWPICPB-UHFFFAOYSA-N
XLogP3.92
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.45
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane?
The IUPAC name of 1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane (CID 84820357) is 1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane.
What is the SMILES notation for 1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane?
The canonical SMILES for 1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane is CCCC(C=C(OCC)OCC)O[Si](C)(C)C.
What is the InChIKey of 1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane?
The InChIKey is QMXKYZKYWPICPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O3Si/c1-7-10-12(16-17(4,5)6)11-13(14-8-2)15-9-3/h11-12H,7-10H2,1-6H3.
What are the key properties of 1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane?
1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane has a molecular weight of 260.45 g/mol, XLogP of 3.92, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diethoxyhex-1-en-3-yloxy(trimethyl)silane is sourced from PubChem (CID 84820357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).