(E)-4-Oxo-4-[1-[3-(Trifluoromethyl)Phenyl]Propan-2-Ylamino]But-2-Enoic Acid
[CAS# 73826-13-8]

Identification

• Name: (E)-4-Oxo-4-[1-[3-(Trifluoromethyl)Phenyl]Propan-2-Ylamino]But-2-Enoic Acid
• Synonyms: (E)-4-[[1-Methyl-2-[3-(Trifluoromethyl)Phenyl]Ethyl]Amino]-4-Oxo-But-2-Enoic Acid; (E)-4-[[1-Methyl-2-[3-(Trifluoromethyl)Phenyl]Ethyl]Amino]-4-Oxobut-2-Enoic Acid; (E)-4-Keto-4-[[1-Methyl-2-[3-(Trifluoromethyl)Phenyl]Ethyl]Amino]But-2-Enoic Acid
• Molecular Formula: C₁₄H₁₄F₃NO₃
• Molecular Weight: 301.26
• CAS Registry Number: 73826-13-8
• SMILES: C1=C(C(F)(F)F)C=CC=C1CC(NC(=O)\C=C\C(=O)O)C
• InChI: 1S/C14H14F3NO3/c1-9(18-12(19)5-6-13(20)21)7-10-3-2-4-11(8-10)14(15,16)17/h2-6,8-9H,7H2,1H3,(H,18,19)(H,20,21)/b6-5+
• InChIKey: GZJNGPZIYDULQU-AATRIKPKSA-N

Properties

• Density: 1.294g/cm³ (Cal.)
• Boiling point: 463.695°C at 760 mmHg (Cal.)
• Flash point: 234.235°C (Cal.)