(2S,3S)-2-((tert-Butoxycarbonyl)amino)-3-phenylbutanoic acid
[CAS# 90731-57-0]

Identification

• Classification: Biochemical >> Amino acids and their derivatives >> Phenylalanine derivatives
• Name: (2S,3S)-2-((tert-Butoxycarbonyl)amino)-3-phenylbutanoic acid
• Synonyms: (2S,3S)-2-(Tert-Butoxycarbonylamino)-3-Phenyl-Butanoate; (2S,3S)-2-[(Tert-Butoxy-Oxomethyl)Amino]-3-Phenylbutanoate; (2S,3S)-2-(Tert-Butoxycarbonylamino)-3-Phenyl-Butyrate
• Molecular Formula: C₁₅H₂₀NO₄
• Molecular Weight: 278.33
• CAS Registry Number: 90731-57-0
• SMILES: [C@@H]([C@H](NC(OC(C)(C)C)=O)C([O-])=O)(C1=CC=CC=C1)C
• InChI: 1S/C15H21NO4/c1-10(11-8-6-5-7-9-11)12(13(17)18)16-14(19)20-15(2,3)4/h5-10,12H,1-4H3,(H,16,19)(H,17,18)/p-1/t10-,12-/m0/s1
• InChIKey: XFSLNPBJZAPTMM-JQWIXIFHSA-M

Properties

• Boiling point: 426.846°C at 760 mmHg (Cal.)
• Flash point: 211.949°C (Cal.)