Phenylmethyl N-[(2S)-3-Methyl-1-Oxo-1-[2-[[(3S)-1,1,1-Trifluoro-4-Methyl-2-Oxopentan-3-Yl]Carbamoyl]Pyrrolidin-1-Yl]Butan-2-Yl]Carbamate
[CAS# 105080-60-2]

Identification

• Name: Phenylmethyl N-[(2S)-3-Methyl-1-Oxo-1-[2-[[(3S)-1,1,1-Trifluoro-4-Methyl-2-Oxopentan-3-Yl]Carbamoyl]Pyrrolidin-1-Yl]Butan-2-Yl]Carbamate
• Synonyms: Phenylmethyl N-[(1S)-2-Methyl-1-[2-[[(1S)-3,3,3-Trifluoro-1-Isopropyl-2-Oxo-Propyl]Carbamoyl]Pyrrolidine-1-Carbonyl]Propyl]Carbamate; N-[(1S)-2-Methyl-1-[Oxo-[2-[Oxo-[[(1S)-3,3,3-Trifluoro-1-Isopropyl-2-Oxopropyl]Amino]Methyl]-1-Pyrrolidinyl]Methyl]Propyl]Carbamic Acid Phenylmethyl Ester; N-[(1S)-2-Methyl-1-[2-[[(1S)-3,3,3-Trifluoro-1-Isopropyl-2-Keto-Propyl]Carbamoyl]Pyrrolidine-1-Carbonyl]Propyl]Carbamic Acid Benzyl Ester
• Molecular Formula: C₂₄H₃₂F₃N₃O₅
• Molecular Weight: 499.53
• CAS Registry Number: 105080-60-2
• SMILES: [C@H](C(N1C(CCC1)C(=O)N[C@H](C(=O)C(F)(F)F)C(C)C)=O)(NC(=O)OCC2=CC=CC=C2)C(C)C
• InChI: 1S/C24H32F3N3O5/c1-14(2)18(20(31)24(25,26)27)28-21(32)17-11-8-12-30(17)22(33)19(15(3)4)29-23(34)35-13-16-9-6-5-7-10-16/h5-7,9-10,14-15,17-19H,8,11-13H2,1-4H3,(H,28,32)(H,29,34)/t17?,18-,19-/m0/s1
• InChIKey: FVOBWOKIKIDXMP-MNNMKWMVSA-N

Properties

• Density: 1.236g/cm³ (Cal.)
• Boiling point: 656.609°C at 760 mmHg (Cal.)
• Flash point: 350.904°C (Cal.)