N2-(Trifluoroacetyl)-L-lysyl-N-(4-(trifluoromethyl)phenyl)-L-Alaninamide
[CAS# 68739-25-3]

Identification

• Name: N2-(Trifluoroacetyl)-L-lysyl-N-(4-(trifluoromethyl)phenyl)-L-Alaninamide
• Synonyms: (2S)-6-Amino-N-[(2S)-1-Oxo-2-[[4-(Trifluoromethyl)Phenyl]Amino]Propyl]-2-[(2,2,2-Trifluoro-1-Oxoethyl)Amino]Hexanamide; (2S)-6-Amino-2-(2,2,2-Trifluoroethanoylamino)-N-[(2S)-2-[[4-(Trifluoromethyl)Phenyl]Amino]Propanoyl]Hexanamide; Trifluoroacetyl-Lysyl-Alanyl-Trifluoromethylphenylanilide
• Molecular Formula: C₁₈H₂₂F₆N₄O₃
• Molecular Weight: 456.39
• CAS Registry Number: 68739-25-3
• SMILES: [C@H](C(=O)NC([C@@H](NC(=O)C(F)(F)F)CCCCN)=O)(NC1=CC=C(C=C1)C(F)(F)F)C
• InChI: 1S/C18H22F6N4O3/c1-10(26-12-7-5-11(6-8-12)17(19,20)21)14(29)28-15(30)13(4-2-3-9-25)27-16(31)18(22,23)24/h5-8,10,13,26H,2-4,9,25H2,1H3,(H,27,31)(H,28,29,30)/t10-,13-/m0/s1
• InChIKey: RWWZMFNNSUSTMW-GWCFXTLKSA-N

Properties

• Density: 1.353g/cm³ (Cal.)
• Boiling point: 580.778°C at 760 mmHg (Cal.)
• Flash point: 305.044°C (Cal.)