4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane

C16H32O3Si — CID 152601261

IUPAC4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane
SMILESC=CC(O[Si](C=C)(OCC)OCC)C(CC)(CC)CC
InChIInChI=1S/C16H32O3Si/c1-8-15(16(9-2,10-3)11-4)19-20(14-7,17-12-5)18-13-6/h8,14-15H,1,7,9-13H2,2-6H3
InChIKeyYXOSDMLBRORLNI-UHFFFAOYSA-N
MW300.52 g/mol
LogP4.51
Rot. Bonds12

About 4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane

4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane (PubChem CID 152601261) has the molecular formula C16H32O3Si and a molecular weight of 300.52 g/mol. Its IUPAC name is 4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane.

Molecular Properties

Compound Name4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane
PubChem CID152601261
Molecular FormulaC16H32O3Si
Molecular Weight300.52 g/mol
Exact Mass300.21
IUPAC Name4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane
SMILESC=CC(O[Si](C=C)(OCC)OCC)C(CC)(CC)CC
InChIInChI=1S/C16H32O3Si/c1-8-15(16(9-2,10-3)11-4)19-20(14-7,17-12-5)18-13-6/h8,14-15H,1,7,9-13H2,2-6H3
InChIKeyYXOSDMLBRORLNI-UHFFFAOYSA-N
XLogP4.51
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.52
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane?
The IUPAC name of 4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane (CID 152601261) is 4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane.
What is the SMILES notation for 4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane?
The canonical SMILES for 4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane is C=CC(O[Si](C=C)(OCC)OCC)C(CC)(CC)CC.
What is the InChIKey of 4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane?
The InChIKey is YXOSDMLBRORLNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O3Si/c1-8-15(16(9-2,10-3)11-4)19-20(14-7,17-12-5)18-13-6/h8,14-15H,1,7,9-13H2,2-6H3.
What are the key properties of 4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane?
4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane has a molecular weight of 300.52 g/mol, XLogP of 4.51, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-diethylhex-1-en-3-yloxy-ethenyl-diethoxysilane is sourced from PubChem (CID 152601261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).