2-[[2-[2-[[3-(Trifluoromethyl)Phenyl]Amino]Benzoyl]Oxyacetyl]Amino]Acetic Acid
[CAS# 38004-34-1]

Identification

• Name: 2-[[2-[2-[[3-(Trifluoromethyl)Phenyl]Amino]Benzoyl]Oxyacetyl]Amino]Acetic Acid
• Synonyms: 2-[[1-Oxo-2-[Oxo-[2-[[3-(Trifluoromethyl)Phenyl]Amino]Phenyl]Methoxy]Ethyl]Amino]Acetic Acid; 2-[2-[2-[[3-(Trifluoromethyl)Phenyl]Amino]Phenyl]Carbonyloxyethanoylamino]Ethanoic Acid; Benzoic Acid, 2-((3-(Trifluoromethyl)Phenyl)Amino)-, 2-((Carboxymethyl)Amino)-2-Oxoethyl Ester
• Molecular Formula: C₁₈H₁₅F₃N₂O₅
• Molecular Weight: 396.32
• CAS Registry Number: 38004-34-1
• SMILES: C1=C(C(=CC=C1)C(OCC(NCC(=O)O)=O)=O)NC2=CC=CC(=C2)C(F)(F)F
• InChI: 1S/C18H15F3N2O5/c19-18(20,21)11-4-3-5-12(8-11)23-14-7-2-1-6-13(14)17(27)28-10-15(24)22-9-16(25)26/h1-8,23H,9-10H2,(H,22,24)(H,25,26)
• InChIKey: NKPPPCNNNKTASW-UHFFFAOYSA-N

Properties

• Density: 1.431g/cm³ (Cal.)
• Boiling point: 621.594°C at 760 mmHg (Cal.)
• Flash point: 329.729°C (Cal.)