ethyl 2-[(tert-butyldimethylsilyl)oxy]acetate

• ChemBase ID: 168447
• Molecular Formular: C10H22O3Si
• Molecular Mass: 218.36538
• Monoisotopic Mass: 218.1338211
• SMILES: O(C(=O)CO[Si](C(C)(C)C)(C)C)CC
• Canonical SMILES: CCOC(=O)CO[Si](C(C)(C)C)(C)C
• InChI: InChI=1S/C10H22O3Si/c1-7-12-9(11)8-13-14(5,6)10(2,3)4/h7-8H2,1-6H3
• InChIKey: VMYQJDCENDEETH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: ethyl 2-[(tert-butyldimethylsilyl)oxy]acetate
• IUPAC Traditional name: ethyl 2-[(tert-butyldimethylsilyl)oxy]acetate
• Synonyms: 2-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]acetic Acid Ethyl Ester; Ethyl [(tert-Butyldimethylsilyl)oxy]acetate

Database IDs

• CAS Number: 67226-78-2
• PubChem SID: 162262579
• PubChem CID: 11183578

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 2.2142
• LogD (pH = 7.4): 2.2142
• Log P: 2.2142
• Molar Refractivity: 53.7117 cm^3
• Polarizability: 23.552006 Å^3
• Polar Surface Area: 35.53 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Acetone; Chloroform; Dichloromethane; Ethyl Acetate; Methanol
• Apperance: Colorless Oil
• Boiling Point: 40-42°C

Safety Information

• Storage Condition: Refrigerator