Methyl (3R)-3-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)-3-Phenylpropanoate
[CAS# 158807-51-3]

Identification

• Name: Methyl (3R)-3-({[(2-Methyl-2-Propanyl)Oxy]Carbonyl}Amino)-3-Phenylpropanoate
• Synonyms: (R)-3-tert-Butoxycarbonylamino-3-phenyl-propionic acid methyl ester; Methyl (R)-N-Boc-3-phenyl-β-alaninate; METHYL(R)-N-BOC-3-PHENYL-β-ALANINATE
• Molecular Formula: C₁₅H₂₁NO₄
• Molecular Weight: 279.33
• CAS Registry Number: 158807-51-3
• SMILES: COC(=O)C[C@@H](NC(=O)OC(C)(C)C)c1ccccc1
• InChI: 1S/C15H21NO4/c1-15(2,3)20-14(18)16-12(10-13(17)19-4)11-8-6-5-7-9-11/h5-9,12H,10H2,1-4H3,(H,16,18)/t12-/m1/s1
• InChIKey: OCQYRBSHPIUCTQ-GFCCVEGCSA-N

Properties

• Density: 1.098g/cm³ (Cal.)
• Boiling point: 398.745°C at 760 mmHg (Cal.)
• Flash point: 194.954°C (Cal.)
• Refractive index: 1.504 (Cal.)