but-2-enoxy-dimethoxy-tetradecylsilane

C20H42O3Si — CID 162729060

IUPACbut-2-enoxy-dimethoxy-tetradecylsilane
SMILESCC=CCO[Si](CCCCCCCCCCCCCC)(OC)OC
InChIInChI=1S/C20H42O3Si/c1-5-7-9-10-11-12-13-14-15-16-17-18-20-24(21-3,22-4)23-19-8-6-2/h6,8H,5,7,9-20H2,1-4H3
InChIKeyCVYHCTDXDNYHFZ-UHFFFAOYSA-N
MW358.64 g/mol
LogP6.51
Rot. Bonds18

About but-2-enoxy-dimethoxy-tetradecylsilane

but-2-enoxy-dimethoxy-tetradecylsilane (PubChem CID 162729060) has the molecular formula C20H42O3Si and a molecular weight of 358.64 g/mol. Its IUPAC name is but-2-enoxy-dimethoxy-tetradecylsilane.

Molecular Properties

Compound Namebut-2-enoxy-dimethoxy-tetradecylsilane
PubChem CID162729060
Molecular FormulaC20H42O3Si
Molecular Weight358.64 g/mol
Exact Mass358.29
IUPAC Namebut-2-enoxy-dimethoxy-tetradecylsilane
SMILESCC=CCO[Si](CCCCCCCCCCCCCC)(OC)OC
InChIInChI=1S/C20H42O3Si/c1-5-7-9-10-11-12-13-14-15-16-17-18-20-24(21-3,22-4)23-19-8-6-2/h6,8H,5,7,9-20H2,1-4H3
InChIKeyCVYHCTDXDNYHFZ-UHFFFAOYSA-N
XLogP6.51
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds18
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.64
LogP ≤ 56.51
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': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of but-2-enoxy-dimethoxy-tetradecylsilane?
The IUPAC name of but-2-enoxy-dimethoxy-tetradecylsilane (CID 162729060) is but-2-enoxy-dimethoxy-tetradecylsilane.
What is the SMILES notation for but-2-enoxy-dimethoxy-tetradecylsilane?
The canonical SMILES for but-2-enoxy-dimethoxy-tetradecylsilane is CC=CCO[Si](CCCCCCCCCCCCCC)(OC)OC.
What is the InChIKey of but-2-enoxy-dimethoxy-tetradecylsilane?
The InChIKey is CVYHCTDXDNYHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42O3Si/c1-5-7-9-10-11-12-13-14-15-16-17-18-20-24(21-3,22-4)23-19-8-6-2/h6,8H,5,7,9-20H2,1-4H3.
What are the key properties of but-2-enoxy-dimethoxy-tetradecylsilane?
but-2-enoxy-dimethoxy-tetradecylsilane has a molecular weight of 358.64 g/mol, XLogP of 6.51, 18 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for but-2-enoxy-dimethoxy-tetradecylsilane is sourced from PubChem (CID 162729060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).