ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane

C16H34O2Si — CID 91740171

IUPACethenyl-(2-ethylhexoxy)-methyl-pentoxysilane
SMILESC=C[Si](C)(OCCCCC)OCC(CC)CCCC
InChIInChI=1S/C16H34O2Si/c1-6-10-12-14-17-19(5,9-4)18-15-16(8-3)13-11-7-2/h9,16H,4,6-8,10-15H2,1-3,5H3
InChIKeyDQDWLZOENLPCBP-UHFFFAOYSA-N
MW286.53 g/mol
LogP5.22
Rot. Bonds13

About ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane

ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane (PubChem CID 91740171) has the molecular formula C16H34O2Si and a molecular weight of 286.53 g/mol. Its IUPAC name is ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane.

Molecular Properties

Compound Nameethenyl-(2-ethylhexoxy)-methyl-pentoxysilane
PubChem CID91740171
Molecular FormulaC16H34O2Si
Molecular Weight286.53 g/mol
Exact Mass286.23
IUPAC Nameethenyl-(2-ethylhexoxy)-methyl-pentoxysilane
SMILESC=C[Si](C)(OCCCCC)OCC(CC)CCCC
InChIInChI=1S/C16H34O2Si/c1-6-10-12-14-17-19(5,9-4)18-15-16(8-3)13-11-7-2/h9,16H,4,6-8,10-15H2,1-3,5H3
InChIKeyDQDWLZOENLPCBP-UHFFFAOYSA-N
XLogP5.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.53
LogP ≤ 55.22
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'}

Analyze ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane 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 ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane?
The IUPAC name of ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane (CID 91740171) is ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane.
What is the SMILES notation for ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane?
The canonical SMILES for ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane is C=C[Si](C)(OCCCCC)OCC(CC)CCCC.
What is the InChIKey of ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane?
The InChIKey is DQDWLZOENLPCBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2Si/c1-6-10-12-14-17-19(5,9-4)18-15-16(8-3)13-11-7-2/h9,16H,4,6-8,10-15H2,1-3,5H3.
What are the key properties of ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane?
ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane has a molecular weight of 286.53 g/mol, XLogP of 5.22, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-(2-ethylhexoxy)-methyl-pentoxysilane is sourced from PubChem (CID 91740171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).