diethyl-(2-methylpropoxy)-pentan-2-yloxysilane

C13H30O2Si — CID 91699865

IUPACdiethyl-(2-methylpropoxy)-pentan-2-yloxysilane
SMILESCCCC(C)O[Si](CC)(CC)OCC(C)C
InChIInChI=1S/C13H30O2Si/c1-7-10-13(6)15-16(8-2,9-3)14-11-12(4)5/h12-13H,7-11H2,1-6H3
InChIKeyAONLGDFGBUWNLF-UHFFFAOYSA-N
MW246.47 g/mol
LogP4.35
Rot. Bonds9

About diethyl-(2-methylpropoxy)-pentan-2-yloxysilane

diethyl-(2-methylpropoxy)-pentan-2-yloxysilane (PubChem CID 91699865) has the molecular formula C13H30O2Si and a molecular weight of 246.47 g/mol. Its IUPAC name is diethyl-(2-methylpropoxy)-pentan-2-yloxysilane.

Molecular Properties

Compound Namediethyl-(2-methylpropoxy)-pentan-2-yloxysilane
PubChem CID91699865
Molecular FormulaC13H30O2Si
Molecular Weight246.47 g/mol
Exact Mass246.20
IUPAC Namediethyl-(2-methylpropoxy)-pentan-2-yloxysilane
SMILESCCCC(C)O[Si](CC)(CC)OCC(C)C
InChIInChI=1S/C13H30O2Si/c1-7-10-13(6)15-16(8-2,9-3)14-11-12(4)5/h12-13H,7-11H2,1-6H3
InChIKeyAONLGDFGBUWNLF-UHFFFAOYSA-N
XLogP4.35
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.47
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

Silane, dimethoxy(1-methylethoxy)(2-methylpropyl)-
CID 86349
Silane, tris(1-methylethoxy)(2-methylpropyl)-
CID 86351
Silane, methoxybis(1-methylethoxy)(2-methylpropyl)-
CID 86350
Trimethyl(1-methylbutoxy)silane
CID 552847
2-Butanol, tert-butyldimethylsilyl ether
CID 14897891
Silane, (1,1-dimethylethyl)dimethyl(1-methylethoxy)-
CID 15696081
Dimethyl-di-2-pentoxysilane
CID 85844809
2-(tert-Butyldimethylsilyloxy)hexane
CID 6430230
4-Methyl-2-pentanol, TMS derivative
CID 13860854
2-Pentanol, TBDMS derivative
CID 14844070
Silane, diethyldiisobutoxy-
CID 22242176
3-Methylbutan-2-ol, tert-butyldimethylsilyl ether
CID 91697265

Frequently Asked Questions

What is the IUPAC name of diethyl-(2-methylpropoxy)-pentan-2-yloxysilane?
The IUPAC name of diethyl-(2-methylpropoxy)-pentan-2-yloxysilane (CID 91699865) is diethyl-(2-methylpropoxy)-pentan-2-yloxysilane.
What is the SMILES notation for diethyl-(2-methylpropoxy)-pentan-2-yloxysilane?
The canonical SMILES for diethyl-(2-methylpropoxy)-pentan-2-yloxysilane is CCCC(C)O[Si](CC)(CC)OCC(C)C.
What is the InChIKey of diethyl-(2-methylpropoxy)-pentan-2-yloxysilane?
The InChIKey is AONLGDFGBUWNLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30O2Si/c1-7-10-13(6)15-16(8-2,9-3)14-11-12(4)5/h12-13H,7-11H2,1-6H3.
What are the key properties of diethyl-(2-methylpropoxy)-pentan-2-yloxysilane?
diethyl-(2-methylpropoxy)-pentan-2-yloxysilane has a molecular weight of 246.47 g/mol, XLogP of 4.35, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(2-methylpropoxy)-pentan-2-yloxysilane is sourced from PubChem (CID 91699865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).