methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate

C11H24O3Si — CID 14650424

IUPACmethyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate
SMILESCOC(=O)C(C)(C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H24O3Si/c1-10(2,3)15(7,8)14-11(4,5)9(12)13-6/h1-8H3
InChIKeyWLOYJVFYWZXBRK-UHFFFAOYSA-N
MW232.40 g/mol
LogP2.96
Rot. Bonds3

About methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate

methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate (PubChem CID 14650424) has the molecular formula C11H24O3Si and a molecular weight of 232.40 g/mol. Its IUPAC name is methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate.

Molecular Properties

Compound Namemethyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate
PubChem CID14650424
Molecular FormulaC11H24O3Si
Molecular Weight232.40 g/mol
Exact Mass232.15
IUPAC Namemethyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate
SMILESCOC(=O)C(C)(C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H24O3Si/c1-10(2,3)15(7,8)14-11(4,5)9(12)13-6/h1-8H3
InChIKeyWLOYJVFYWZXBRK-UHFFFAOYSA-N
XLogP2.96
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.40
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate?
The IUPAC name of methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate (CID 14650424) is methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate.
What is the SMILES notation for methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate?
The canonical SMILES for methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate is COC(=O)C(C)(C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate?
The InChIKey is WLOYJVFYWZXBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3Si/c1-10(2,3)15(7,8)14-11(4,5)9(12)13-6/h1-8H3.
What are the key properties of methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate?
methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate has a molecular weight of 232.40 g/mol, XLogP of 2.96, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate is sourced from PubChem (CID 14650424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).