(2S)-3-(2-Methylphenyl)-2-[(2-Methylpropan-2-Yl)Oxycarbonylamino]Propanoate
[CAS# 139558-50-2]

Identification

• Classification: Biochemical >> Amino acids and their derivatives >> Phenylalanine derivatives
• Name: (2S)-3-(2-Methylphenyl)-2-[(2-Methylpropan-2-Yl)Oxycarbonylamino]Propanoate
• Synonyms: (2S)-2-(Tert-Butoxycarbonylamino)-3-(2-Methylphenyl)Propanoate; (2S)-2-[(Tert-Butoxy-Oxomethyl)Amino]-3-(2-Methylphenyl)Propanoate; (2S)-2-(Tert-Butoxycarbonylamino)-3-(2-Methylphenyl)Propionate
• Molecular Formula: C₁₅H₂₀NO₄
• Molecular Weight: 278.33
• CAS Registry Number: 139558-50-2
• SMILES: [C@H](NC(OC(C)(C)C)=O)(CC1=CC=CC=C1C)C([O-])=O
• InChI: 1S/C15H21NO4/c1-10-7-5-6-8-11(10)9-12(13(17)18)16-14(19)20-15(2,3)4/h5-8,12H,9H2,1-4H3,(H,16,19)(H,17,18)/p-1/t12-/m0/s1
• InChIKey: PCGOCPOJLMLJAR-LBPRGKRZSA-M

Properties

• Boiling point: 442.535°C at 760 mmHg (Cal.)
• Flash point: 221.437°C (Cal.)