tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane

C13H30O3Si — CID 91719369

IUPACtert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane
SMILESCOC(CC(C)(C)O[Si](C)(C)C(C)(C)C)OC
InChIInChI=1S/C13H30O3Si/c1-12(2,3)17(8,9)16-13(4,5)10-11(14-6)15-7/h11H,10H2,1-9H3
InChIKeyWCXGNEBTPPNZIR-UHFFFAOYSA-N
MW262.47 g/mol
LogP3.80
Rot. Bonds6

About tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane

tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane (PubChem CID 91719369) has the molecular formula C13H30O3Si and a molecular weight of 262.47 g/mol. Its IUPAC name is tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane
PubChem CID91719369
Molecular FormulaC13H30O3Si
Molecular Weight262.47 g/mol
Exact Mass262.20
IUPAC Nametert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane
SMILESCOC(CC(C)(C)O[Si](C)(C)C(C)(C)C)OC
InChIInChI=1S/C13H30O3Si/c1-12(2,3)17(8,9)16-13(4,5)10-11(14-6)15-7/h11H,10H2,1-9H3
InChIKeyWCXGNEBTPPNZIR-UHFFFAOYSA-N
XLogP3.80
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.47
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

Triethyl-(3-methoxy-3-methylbutoxy)silane
CID 12755144
4,4-Dimethoxy-2-methyl-2-butanol, TMS derivative
CID 91697256
Triethyl-(4-methoxy-2-methylbutan-2-yl)oxysilane
CID 12755147
Tert-butyl(1-(2,2-dimethoxyethyl)cyclopropoxy)dimethylsilane
CID 90299540
Butyl-(3,3-dimethoxybutoxy)-dimethylsilane
CID 175242658
tert-butyl-[(2S)-3,3-dimethoxy-2-methylpropoxy]-dimethylsilane
CID 10444722
Tert-butyl-(4,4-dimethoxy-3-methylbutoxy)-dimethylsilane
CID 15724257
Tert-butyl-[3-(methoxymethoxy)butoxy]-dimethylsilane
CID 101016624
Tert-butyl-[4-(methoxymethoxy)butan-2-yloxy]-dimethylsilane
CID 101016626

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane?
The IUPAC name of tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane (CID 91719369) is tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane?
The canonical SMILES for tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane is COC(CC(C)(C)O[Si](C)(C)C(C)(C)C)OC.
What is the InChIKey of tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane?
The InChIKey is WCXGNEBTPPNZIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30O3Si/c1-12(2,3)17(8,9)16-13(4,5)10-11(14-6)15-7/h11H,10H2,1-9H3.
What are the key properties of tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane?
tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane has a molecular weight of 262.47 g/mol, XLogP of 3.80, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(4,4-dimethoxy-2-methylbutan-2-yl)oxy-dimethylsilane is sourced from PubChem (CID 91719369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).