Phenylmethyl (2S)-1-[(2S)-4-Amino-2-[(2-Methylpropan-2-Yl)Oxycarbonylamino]-4-Oxobutanoyl]Pyrrolidine-2-Carboxylate
[CAS# 35930-84-8]

Identification

• Name: Phenylmethyl (2S)-1-[(2S)-4-Amino-2-[(2-Methylpropan-2-Yl)Oxycarbonylamino]-4-Oxobutanoyl]Pyrrolidine-2-Carboxylate
• Synonyms: Phenylmethyl (2S)-1-[(2S)-4-Amino-2-(Tert-Butoxycarbonylamino)-4-Oxo-Butanoyl]Pyrrolidine-2-Carboxylate; (2S)-1-[(2S)-4-Amino-2-[(Tert-Butoxy-Oxomethyl)Amino]-1,4-Dioxobutyl]-2-Pyrrolidinecarboxylic Acid Phenylmethyl Ester; (2S)-1-[(2S)-4-Amino-2-(Tert-Butoxycarbonylamino)-4-Keto-Butanoyl]Pyrrolidine-2-Carboxylic Acid Benzyl Ester
• Molecular Formula: C₂₁H₂₉N₃O₆
• Molecular Weight: 419.48
• CAS Registry Number: 35930-84-8
• SMILES: [C@H]2(C(=O)OCC1=CC=CC=C1)N(CCC2)C([C@@H](NC(=O)OC(C)(C)C)CC(=O)N)=O
• InChI: 1S/C21H29N3O6/c1-21(2,3)30-20(28)23-15(12-17(22)25)18(26)24-11-7-10-16(24)19(27)29-13-14-8-5-4-6-9-14/h4-6,8-9,15-16H,7,10-13H2,1-3H3,(H2,22,25)(H,23,28)/t15-,16-/m0/s1
• InChIKey: RUWTZERCBURAOJ-HOTGVXAUSA-N

Properties

• Density: 1.24g/cm³ (Cal.)
• Boiling point: 648.11°C at 760 mmHg (Cal.)
• Flash point: 345.765°C (Cal.)