[(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane

C26H54O2Si — CID 91715841

IUPAC[(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane
SMILESCCCCC/C=C/CCCO[Si](C)(C)OCCCCCCCCCCCCCC
InChIInChI=1S/C26H54O2Si/c1-5-7-9-11-13-15-16-17-18-20-22-24-26-28-29(3,4)27-25-23-21-19-14-12-10-8-6-2/h14,19H,5-13,15-18,20-26H2,1-4H3/b19-14+
InChIKeyIVHKTMMGFQSYMG-XMHGGMMESA-N
MW426.80 g/mol
LogP9.34
Rot. Bonds23

About [(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane

[(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane (PubChem CID 91715841) has the molecular formula C26H54O2Si and a molecular weight of 426.80 g/mol. Its IUPAC name is [(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane.

Molecular Properties

Compound Name[(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane
PubChem CID91715841
Molecular FormulaC26H54O2Si
Molecular Weight426.80 g/mol
Exact Mass426.39
IUPAC Name[(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane
SMILESCCCCC/C=C/CCCO[Si](C)(C)OCCCCCCCCCCCCCC
InChIInChI=1S/C26H54O2Si/c1-5-7-9-11-13-15-16-17-18-20-22-24-26-28-29(3,4)27-25-23-21-19-14-12-10-8-6-2/h14,19H,5-13,15-18,20-26H2,1-4H3/b19-14+
InChIKeyIVHKTMMGFQSYMG-XMHGGMMESA-N
XLogP9.34
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds23
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.80
LogP ≤ 59.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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'}

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Frequently Asked Questions

What is the IUPAC name of [(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane?
The IUPAC name of [(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane (CID 91715841) is [(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane.
What is the SMILES notation for [(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane?
The canonical SMILES for [(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane is CCCCC/C=C/CCCO[Si](C)(C)OCCCCCCCCCCCCCC.
What is the InChIKey of [(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane?
The InChIKey is IVHKTMMGFQSYMG-XMHGGMMESA-N. The full InChI is InChI=1S/C26H54O2Si/c1-5-7-9-11-13-15-16-17-18-20-22-24-26-28-29(3,4)27-25-23-21-19-14-12-10-8-6-2/h14,19H,5-13,15-18,20-26H2,1-4H3/b19-14+.
What are the key properties of [(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane?
[(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane has a molecular weight of 426.80 g/mol, XLogP of 9.34, 23 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-dec-4-enoxy]-dimethyl-tetradecoxysilane is sourced from PubChem (CID 91715841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).