(2S)-3-[(tert-butyldimethylsilyl)oxy]-2-methylpropan-1-ol

• ChemBase ID: 163370
• Molecular Formular: C10H24O2Si
• Molecular Mass: 204.38186
• Monoisotopic Mass: 204.15455654
• SMILES: O([Si](C)(C)C(C)(C)C)C[C@H](CO)C
• Canonical SMILES: OC[C@@H](CO[Si](C(C)(C)C)(C)C)C
• InChI: InChI=1S/C10H24O2Si/c1-9(7-11)8-12-13(5,6)10(2,3)4/h9,11H,7-8H2,1-6H3/t9-/m0/s1
• InChIKey: OAWLYVJZJYEJSM-VIFPVBQESA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2S)-3-[(tert-butyldimethylsilyl)oxy]-2-methylpropan-1-ol
• IUPAC Traditional name: (2S)-3-[(tert-butyldimethylsilyl)oxy]-2-methylpropan-1-ol
• Synonyms: (2S)-3-[[(1,1-Dimethylethyl)dimethylsilyl]oxy]-2-methyl-1-propanol; (2S)-3-{[tert-Butyl(dimethyl)silyl]oxy}-2-methylpropan-1-ol

Database IDs

• CAS Number: 105859-45-8
• PubChem SID: 162257505
• PubChem CID: 11735865

CALCULATED PROPERTIES

• Acid pKa: 15.409463
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 2.1098
• LogD (pH = 7.4): 2.1098
• Log P: 2.1098
• Molar Refractivity: 53.6835 cm^3
• Polarizability: 23.390564 Å^3
• Polar Surface Area: 29.46 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Dichloromethane; Ether; Ethyl Acetate; Hexane
• Apperance: Pale Yellow Oil

Safety Information

• Storage Condition: -20°C Freezer