bis(but-1-enyl)-diethoxysilane

C12H24O2Si — CID 74017856

IUPACbis(but-1-enyl)-diethoxysilane
SMILESCCC=C[Si](C=CCC)(OCC)OCC
InChIInChI=1S/C12H24O2Si/c1-5-9-11-15(13-7-3,14-8-4)12-10-6-2/h9-12H,5-8H2,1-4H3
InChIKeyVNMPPQAHWPXOHC-UHFFFAOYSA-N
MW228.41 g/mol
LogP3.51
Rot. Bonds8

About bis(but-1-enyl)-diethoxysilane

bis(but-1-enyl)-diethoxysilane (PubChem CID 74017856) has the molecular formula C12H24O2Si and a molecular weight of 228.41 g/mol. Its IUPAC name is bis(but-1-enyl)-diethoxysilane.

Molecular Properties

Compound Namebis(but-1-enyl)-diethoxysilane
PubChem CID74017856
Molecular FormulaC12H24O2Si
Molecular Weight228.41 g/mol
Exact Mass228.15
IUPAC Namebis(but-1-enyl)-diethoxysilane
SMILESCCC=C[Si](C=CCC)(OCC)OCC
InChIInChI=1S/C12H24O2Si/c1-5-9-11-15(13-7-3,14-8-4)12-10-6-2/h9-12H,5-8H2,1-4H3
InChIKeyVNMPPQAHWPXOHC-UHFFFAOYSA-N
XLogP3.51
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.41
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze bis(but-1-enyl)-diethoxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(but-1-enyl)-diethoxysilane?
The IUPAC name of bis(but-1-enyl)-diethoxysilane (CID 74017856) is bis(but-1-enyl)-diethoxysilane.
What is the SMILES notation for bis(but-1-enyl)-diethoxysilane?
The canonical SMILES for bis(but-1-enyl)-diethoxysilane is CCC=C[Si](C=CCC)(OCC)OCC.
What is the InChIKey of bis(but-1-enyl)-diethoxysilane?
The InChIKey is VNMPPQAHWPXOHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2Si/c1-5-9-11-15(13-7-3,14-8-4)12-10-6-2/h9-12H,5-8H2,1-4H3.
What are the key properties of bis(but-1-enyl)-diethoxysilane?
bis(but-1-enyl)-diethoxysilane has a molecular weight of 228.41 g/mol, XLogP of 3.51, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(but-1-enyl)-diethoxysilane is sourced from PubChem (CID 74017856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).