(2S)-4-Oxo-2-[(2R)-Oxolan-2-Yl]-4-[[3-(Trifluoromethyl)Phenyl]Amino]Butanoic acid
[CAS# 330951-09-2]

Identification

• Name: (2S)-4-Oxo-2-[(2R)-Oxolan-2-Yl]-4-[[3-(Trifluoromethyl)Phenyl]Amino]Butanoic acid
• Synonyms: (2S)-4-Oxo-2-[(2R)-Tetrahydrofuran-2-Yl]-4-[[3-(Trifluoromethyl)Phenyl]Amino]Butanoate; (2S)-4-Oxo-2-[(2R)-2-Tetrahydrofuranyl]-4-[[3-(Trifluoromethyl)Phenyl]Amino]Butanoate; (2S)-4-Keto-2-(Tetrahydrofuryl)-4-[[3-(Trifluoromethyl)Phenyl]Amino]Butyrate
• Molecular Formula: C₁₅H₁₅F₃NO₄
• Molecular Weight: 330.28
• CAS Registry Number: 330951-09-2
• SMILES: [C@H]([C@@H]1OCCC1)(C([O-])=O)CC(=O)NC2=CC(=CC=C2)C(F)(F)F
• InChI: 1S/C15H16F3NO4/c16-15(17,18)9-3-1-4-10(7-9)19-13(20)8-11(14(21)22)12-5-2-6-23-12/h1,3-4,7,11-12H,2,5-6,8H2,(H,19,20)(H,21,22)/p-1/t11-,12+/m0/s1
• InChIKey: WGAHLUJFRZDFHK-NWDGAFQWSA-M

Properties

• Boiling point: 515.334°C at 760 mmHg (Cal.)
• Flash point: 265.465°C (Cal.)