ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane

C19H40O3Si2 — CID 91726821

IUPACethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane
SMILESC=C[Si](C)(OCCCCC)O[Si](C)(C=C)OCCCCCCCC
InChIInChI=1S/C19H40O3Si2/c1-7-11-13-14-15-17-19-21-24(6,10-4)22-23(5,9-3)20-18-16-12-8-2/h9-10H,3-4,7-8,11-19H2,1-2,5-6H3
InChIKeyGIYAJYNQDKAJFN-UHFFFAOYSA-N
MW372.70 g/mol
LogP6.18
Rot. Bonds17

About ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane

ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane (PubChem CID 91726821) has the molecular formula C19H40O3Si2 and a molecular weight of 372.70 g/mol. Its IUPAC name is ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane.

Molecular Properties

Compound Nameethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane
PubChem CID91726821
Molecular FormulaC19H40O3Si2
Molecular Weight372.70 g/mol
Exact Mass372.25
IUPAC Nameethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane
SMILESC=C[Si](C)(OCCCCC)O[Si](C)(C=C)OCCCCCCCC
InChIInChI=1S/C19H40O3Si2/c1-7-11-13-14-15-17-19-21-24(6,10-4)22-23(5,9-3)20-18-16-12-8-2/h9-10H,3-4,7-8,11-19H2,1-2,5-6H3
InChIKeyGIYAJYNQDKAJFN-UHFFFAOYSA-N
XLogP6.18
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds17
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.70
LogP ≤ 56.18
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'}

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Frequently Asked Questions

What is the IUPAC name of ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane?
The IUPAC name of ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane (CID 91726821) is ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane.
What is the SMILES notation for ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane?
The canonical SMILES for ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane is C=C[Si](C)(OCCCCC)O[Si](C)(C=C)OCCCCCCCC.
What is the InChIKey of ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane?
The InChIKey is GIYAJYNQDKAJFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40O3Si2/c1-7-11-13-14-15-17-19-21-24(6,10-4)22-23(5,9-3)20-18-16-12-8-2/h9-10H,3-4,7-8,11-19H2,1-2,5-6H3.
What are the key properties of ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane?
ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane has a molecular weight of 372.70 g/mol, XLogP of 6.18, 17 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-(ethenyl-methyl-octoxysilyl)oxy-methyl-pentoxysilane is sourced from PubChem (CID 91726821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).