Methyl (2S)-2-[[2-(2,5-Dioxopyrrolidin-1-Yl)Acetyl]-[(2-Methylpropan-2-Yl)Oxycarbonyl-[(2S)-Pyrrolidine-2-Carbonyl]Amino]Amino]Propanoate
[CAS# 142453-08-5]

Identification

• Name: Methyl (2S)-2-[[2-(2,5-Dioxopyrrolidin-1-Yl)Acetyl]-[(2-Methylpropan-2-Yl)Oxycarbonyl-[(2S)-Pyrrolidine-2-Carbonyl]Amino]Amino]Propanoate
• Synonyms: Methyl (2S)-2-[[Tert-Butoxycarbonyl-[(2S)-Pyrrolidine-2-Carbonyl]Amino]-[2-(2,5-Dioxopyrrolidin-1-Yl)Acetyl]Amino]Propanoate; (2S)-2-[[(Tert-Butoxy-Oxomethyl)-[Oxo-[(2S)-2-Pyrrolidinyl]Methyl]Amino]-[2-(2,5-Dioxo-1-Pyrrolidinyl)-1-Oxoethyl]Amino]Propanoic Acid Methyl Ester; (2S)-2-[(Tert-Butoxycarbonyl-Prolyl-Amino)-(2-Succinimidoacetyl)Amino]Propionic Acid Methyl Ester
• Molecular Formula: C₂₀H₃₀N₄O₈
• Molecular Weight: 454.48
• CAS Registry Number: 142453-08-5
• SMILES: [C@H](C(=O)OC)(N(C(CN1C(=O)CCC1=O)=O)N(C([C@H]2NCCC2)=O)C(=O)OC(C)(C)C)C
• InChI: 1S/C20H30N4O8/c1-12(18(29)31-5)23(16(27)11-22-14(25)8-9-15(22)26)24(19(30)32-20(2,3)4)17(28)13-7-6-10-21-13/h12-13,21H,6-11H2,1-5H3/t12-,13-/m0/s1
• InChIKey: OWSCRYZTKYSSOC-STQMWFEESA-N

Properties

• Density: 1.303g/cm³ (Cal.)
• Boiling point: 600.906°C at 760 mmHg (Cal.)
• Flash point: 317.217°C (Cal.)