methyl (2R)-3-[(tert-butyldimethylsilyl)oxy]-2-methylpropanoate

• ChemBase ID: 173431
• Molecular Formular: C11H24O3Si
• Molecular Mass: 232.39196
• Monoisotopic Mass: 232.14947116
• SMILES: [C@@H](C(=O)OC)(C)CO[Si](C(C)(C)C)(C)C
• Canonical SMILES: COC(=O)[C@@H](CO[Si](C(C)(C)C)(C)C)C
• InChI: InChI=1S/C11H24O3Si/c1-9(10(12)13-5)8-14-15(6,7)11(2,3)4/h9H,8H2,1-7H3/t9-/m1/s1
• InChIKey: GDTYFCRFIVSEIF-SECBINFHSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methyl (2R)-3-[(tert-butyldimethylsilyl)oxy]-2-methylpropanoate
• IUPAC Traditional name: methyl (2R)-3-[(tert-butyldimethylsilyl)oxy]-2-methylpropanoate
• Synonyms: (R)-3-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]-2-methyl-propanoic Acid Methyl Ester; (2R)-Methyl 3-{[tert-Butyldimethylsilyl)oxy]}-2-methylpropionate

Database IDs

• CAS Number: 105859-44-7
• PubChem SID: 164229341
• PubChem CID: 11831316

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 2.6154
• LogD (pH = 7.4): 2.6154
• Log P: 2.6154
• Molar Refractivity: 58.237 cm^3
• Polarizability: 25.388514 Å^3
• Polar Surface Area: 35.53 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Dichloromethane; Ether; Ethyl Acetate; Hexane
• Apperance: Colourless Oil

Safety Information

• Storage Condition: Refrigerator