diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane

C15H34O2Si — CID 91698400

IUPACdiethyl-(2-methylbutoxy)-(4-methylpentoxy)silane
SMILESCCC(C)CO[Si](CC)(CC)OCCCC(C)C
InChIInChI=1S/C15H34O2Si/c1-7-15(6)13-17-18(8-2,9-3)16-12-10-11-14(4)5/h14-15H,7-13H2,1-6H3
InChIKeyJFFIKRWJKBGQJF-UHFFFAOYSA-N
MW274.52 g/mol
LogP4.98
Rot. Bonds11

About diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane

diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane (PubChem CID 91698400) has the molecular formula C15H34O2Si and a molecular weight of 274.52 g/mol. Its IUPAC name is diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane.

Molecular Properties

Compound Namediethyl-(2-methylbutoxy)-(4-methylpentoxy)silane
PubChem CID91698400
Molecular FormulaC15H34O2Si
Molecular Weight274.52 g/mol
Exact Mass274.23
IUPAC Namediethyl-(2-methylbutoxy)-(4-methylpentoxy)silane
SMILESCCC(C)CO[Si](CC)(CC)OCCCC(C)C
InChIInChI=1S/C15H34O2Si/c1-7-15(6)13-17-18(8-2,9-3)16-12-10-11-14(4)5/h14-15H,7-13H2,1-6H3
InChIKeyJFFIKRWJKBGQJF-UHFFFAOYSA-N
XLogP4.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.52
LogP ≤ 54.98
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 diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane?
The IUPAC name of diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane (CID 91698400) is diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane.
What is the SMILES notation for diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane?
The canonical SMILES for diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane is CCC(C)CO[Si](CC)(CC)OCCCC(C)C.
What is the InChIKey of diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane?
The InChIKey is JFFIKRWJKBGQJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34O2Si/c1-7-15(6)13-17-18(8-2,9-3)16-12-10-11-14(4)5/h14-15H,7-13H2,1-6H3.
What are the key properties of diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane?
diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane has a molecular weight of 274.52 g/mol, XLogP of 4.98, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(2-methylbutoxy)-(4-methylpentoxy)silane is sourced from PubChem (CID 91698400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).