(2R)-1-methoxypropan-2-ol

• ChemBase ID: 796781
• Molecular Formular: C4H10O2
• Molecular Mass: 90.121
• Monoisotopic Mass: 90.06807956
• SMILES: C([C@@H](C)O)OC
• Canonical SMILES: COC[C@H](O)C
• InChI: InChI=1S/C4H10O2/c1-4(5)3-6-2/h4-5H,3H2,1-2H3/t4-/m1/s1
• InChIKey: ARXJGSRGQADJSQ-SCSAIBSYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2R)-1-methoxypropan-2-ol
• IUPAC Traditional name: (2R)-1-methoxypropan-2-ol
• Synonyms: (R)-(-)-1-Methoxy-2-propanol

Database IDs

• CAS Number: 4984-22-9

CALCULATED PROPERTIES

• Acid pKa: 14.854453
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.14897755
• LogD (pH = 7.4): -0.14897756
• Log P: -0.14897755
• Molar Refractivity: 23.7236 cm^3
• Polarizability: 9.428219 Å^3
• Polar Surface Area: 29.46 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 97%