decan-2-yloxy-ethoxy-diphenylsilane

C24H36O2Si — CID 91736306

IUPACdecan-2-yloxy-ethoxy-diphenylsilane
SMILESCCCCCCCCC(C)O[Si](OCC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H36O2Si/c1-4-6-7-8-9-12-17-22(3)26-27(25-5-2,23-18-13-10-14-19-23)24-20-15-11-16-21-24/h10-11,13-16,18-22H,4-9,12,17H2,1-3H3
InChIKeyJIBKELXUGXUXKR-UHFFFAOYSA-N
MW384.64 g/mol
LogP5.44
Rot. Bonds13

About decan-2-yloxy-ethoxy-diphenylsilane

decan-2-yloxy-ethoxy-diphenylsilane (PubChem CID 91736306) has the molecular formula C24H36O2Si and a molecular weight of 384.64 g/mol. Its IUPAC name is decan-2-yloxy-ethoxy-diphenylsilane.

Molecular Properties

Compound Namedecan-2-yloxy-ethoxy-diphenylsilane
PubChem CID91736306
Molecular FormulaC24H36O2Si
Molecular Weight384.64 g/mol
Exact Mass384.25
IUPAC Namedecan-2-yloxy-ethoxy-diphenylsilane
SMILESCCCCCCCCC(C)O[Si](OCC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H36O2Si/c1-4-6-7-8-9-12-17-22(3)26-27(25-5-2,23-18-13-10-14-19-23)24-20-15-11-16-21-24/h10-11,13-16,18-22H,4-9,12,17H2,1-3H3
InChIKeyJIBKELXUGXUXKR-UHFFFAOYSA-N
XLogP5.44
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.64
LogP ≤ 55.44
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'}

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Frequently Asked Questions

What is the IUPAC name of decan-2-yloxy-ethoxy-diphenylsilane?
The IUPAC name of decan-2-yloxy-ethoxy-diphenylsilane (CID 91736306) is decan-2-yloxy-ethoxy-diphenylsilane.
What is the SMILES notation for decan-2-yloxy-ethoxy-diphenylsilane?
The canonical SMILES for decan-2-yloxy-ethoxy-diphenylsilane is CCCCCCCCC(C)O[Si](OCC)(c1ccccc1)c1ccccc1.
What is the InChIKey of decan-2-yloxy-ethoxy-diphenylsilane?
The InChIKey is JIBKELXUGXUXKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H36O2Si/c1-4-6-7-8-9-12-17-22(3)26-27(25-5-2,23-18-13-10-14-19-23)24-20-15-11-16-21-24/h10-11,13-16,18-22H,4-9,12,17H2,1-3H3.
What are the key properties of decan-2-yloxy-ethoxy-diphenylsilane?
decan-2-yloxy-ethoxy-diphenylsilane has a molecular weight of 384.64 g/mol, XLogP of 5.44, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for decan-2-yloxy-ethoxy-diphenylsilane is sourced from PubChem (CID 91736306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).