diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane

C16H36O2Si — CID 91698408

IUPACdiethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane
SMILESCC[Si](CC)(OCCCC(C)C)OC(C)CC(C)C
InChIInChI=1S/C16H36O2Si/c1-8-19(9-2,17-12-10-11-14(3)4)18-16(7)13-15(5)6/h14-16H,8-13H2,1-7H3
InChIKeyHDKZBYYYBUNVBQ-UHFFFAOYSA-N
MW288.55 g/mol
LogP5.37
Rot. Bonds11

About diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane

diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane (PubChem CID 91698408) has the molecular formula C16H36O2Si and a molecular weight of 288.55 g/mol. Its IUPAC name is diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane.

Molecular Properties

Compound Namediethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane
PubChem CID91698408
Molecular FormulaC16H36O2Si
Molecular Weight288.55 g/mol
Exact Mass288.25
IUPAC Namediethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane
SMILESCC[Si](CC)(OCCCC(C)C)OC(C)CC(C)C
InChIInChI=1S/C16H36O2Si/c1-8-19(9-2,17-12-10-11-14(3)4)18-16(7)13-15(5)6/h14-16H,8-13H2,1-7H3
InChIKeyHDKZBYYYBUNVBQ-UHFFFAOYSA-N
XLogP5.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.55
LogP ≤ 55.37
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

4-Methyl-2-pentanol, TMS derivative
CID 13860854
2-Methyl-1-pentanol, tert-butyldimethylsilyl ether
CID 86203641
2-Methyl-4-triisobutylsilyloxyoct-5-yne
CID 531263
2-Methyl-4-tripropylsilyloxyoct-5-yne
CID 531307
2-Methyl-4-tributylsilyloxyoct-5-yne
CID 531337
2-Methyl-3-pentanol, tert-butyldimethylsilyl ether
CID 91697285
Dimethylpyrrolbis[(2-methylpentyl)oxy]morphosilane
CID 91697347
Silane, dimethylisobutoxyisohexyloxy-
CID 91698388
Silane, dimethyl(3-heptyloxy)isohexyloxy-
CID 91698390
Silane, dimethyl(2-methylbutoxy)isohexyloxy-
CID 91698394
Silane, diethyl(3,3-dimethylbut-2-yloxy)isohexyloxy-
CID 91698395
Silane, dimethyldiisohexyloxy-
CID 91698398

Frequently Asked Questions

What is the IUPAC name of diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane?
The IUPAC name of diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane (CID 91698408) is diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane.
What is the SMILES notation for diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane?
The canonical SMILES for diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane is CC[Si](CC)(OCCCC(C)C)OC(C)CC(C)C.
What is the InChIKey of diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane?
The InChIKey is HDKZBYYYBUNVBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O2Si/c1-8-19(9-2,17-12-10-11-14(3)4)18-16(7)13-15(5)6/h14-16H,8-13H2,1-7H3.
What are the key properties of diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane?
diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane has a molecular weight of 288.55 g/mol, XLogP of 5.37, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(4-methylpentan-2-yloxy)-(4-methylpentoxy)silane is sourced from PubChem (CID 91698408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).