N-[(1Z)-4,4,4-Trifluoro-3-Oxo-1-Buten-1-Yl]-L-Phenylalanine
[CAS# 133992-79-7]

Identification

• Name: N-[(1Z)-4,4,4-Trifluoro-3-Oxo-1-Buten-1-Yl]-L-Phenylalanine
• Synonyms: (2S)-3-Phenyl-2-[(4,4,4-Trifluoro-3-Oxo-Butylidene)Amino]Propanoate; (2S)-3-Phenyl-2-[(4,4,4-Trifluoro-3-Keto-Butylidene)Amino]Propionate; Zinc02561294
• Molecular Formula: C₁₃H₁₁F₃NO₃
• Molecular Weight: 286.23
• CAS Registry Number: 133992-79-7
• SMILES: [C@@H](N=CCC(=O)C(F)(F)F)(C([O-])=O)CC1=CC=CC=C1
• InChI: 1S/C13H12F3NO3/c14-13(15,16)11(18)6-7-17-10(12(19)20)8-9-4-2-1-3-5-9/h1-5,7,10H,6,8H2,(H,19,20)/p-1/t10-/m0/s1
• InChIKey: CXMJSIBQFRPVIV-JTQLQIEISA-M

Properties

• Boiling point: 377.164°C at 760 mmHg (Cal.)
• Flash point: 181.903°C (Cal.)