diethyl-(4-methylpentoxy)-pentan-2-yloxysilane

C15H34O2Si — CID 91738212

IUPACdiethyl-(4-methylpentoxy)-pentan-2-yloxysilane
SMILESCCCC(C)O[Si](CC)(CC)OCCCC(C)C
InChIInChI=1S/C15H34O2Si/c1-7-11-15(6)17-18(8-2,9-3)16-13-10-12-14(4)5/h14-15H,7-13H2,1-6H3
InChIKeySFEMAQHBWOXCOD-UHFFFAOYSA-N
MW274.52 g/mol
LogP5.13
Rot. Bonds11

About diethyl-(4-methylpentoxy)-pentan-2-yloxysilane

diethyl-(4-methylpentoxy)-pentan-2-yloxysilane (PubChem CID 91738212) has the molecular formula C15H34O2Si and a molecular weight of 274.52 g/mol. Its IUPAC name is diethyl-(4-methylpentoxy)-pentan-2-yloxysilane.

Molecular Properties

Compound Namediethyl-(4-methylpentoxy)-pentan-2-yloxysilane
PubChem CID91738212
Molecular FormulaC15H34O2Si
Molecular Weight274.52 g/mol
Exact Mass274.23
IUPAC Namediethyl-(4-methylpentoxy)-pentan-2-yloxysilane
SMILESCCCC(C)O[Si](CC)(CC)OCCCC(C)C
InChIInChI=1S/C15H34O2Si/c1-7-11-15(6)17-18(8-2,9-3)16-13-10-12-14(4)5/h14-15H,7-13H2,1-6H3
InChIKeySFEMAQHBWOXCOD-UHFFFAOYSA-N
XLogP5.13
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.52
LogP ≤ 55.13
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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Related Compounds

diethyl-octadecoxy-pentan-2-yloxysilane
CID 91744997
diethyl-(4-methylpentan-2-yloxy)-octadecoxysilane
CID 91745192
diethyl-(3-methylbutoxy)-pentadecoxysilane
CID 91744142
diethyl-(2-ethylhexoxy)-(4-methylpentoxy)silane
CID 91741054
decoxy-diethyl-heptan-4-yloxysilane
CID 91742826
butoxy-dimethyl-pentan-2-yloxysilane
CID 91726705
dibutoxy-ethyl-(2-methylpropyl)silane
CID 87899678
diethyl-octadecoxy-octan-4-yloxysilane
CID 91745529
diethyl-hexadecoxy-octan-4-yloxysilane
CID 91745179
dimethyl-octoxy-pentan-2-yloxysilane
CID 91736775
heptoxy-dimethyl-(4-methylpentoxy)silane
CID 91739178
hexadecoxy-dimethyl-(4-methylpentoxy)silane
CID 91744434

Frequently Asked Questions

What is the IUPAC name of diethyl-(4-methylpentoxy)-pentan-2-yloxysilane?
The IUPAC name of diethyl-(4-methylpentoxy)-pentan-2-yloxysilane (CID 91738212) is diethyl-(4-methylpentoxy)-pentan-2-yloxysilane.
What is the SMILES notation for diethyl-(4-methylpentoxy)-pentan-2-yloxysilane?
The canonical SMILES for diethyl-(4-methylpentoxy)-pentan-2-yloxysilane is CCCC(C)O[Si](CC)(CC)OCCCC(C)C.
What is the InChIKey of diethyl-(4-methylpentoxy)-pentan-2-yloxysilane?
The InChIKey is SFEMAQHBWOXCOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34O2Si/c1-7-11-15(6)17-18(8-2,9-3)16-13-10-12-14(4)5/h14-15H,7-13H2,1-6H3.
What are the key properties of diethyl-(4-methylpentoxy)-pentan-2-yloxysilane?
diethyl-(4-methylpentoxy)-pentan-2-yloxysilane has a molecular weight of 274.52 g/mol, XLogP of 5.13, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(4-methylpentoxy)-pentan-2-yloxysilane is sourced from PubChem (CID 91738212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).