3-(2-Thienyl)-3-[(2,2,2-Trifluoroacetyl)Amino]Propanoic Acid
[CAS 115957-22-7]

Identification

• Name: 3-(2-Thienyl)-3-[(2,2,2-Trifluoroacetyl)Amino]Propanoic Acid
• Synonyms: (3S)-3-(2-Thienyl)-3-[(2,2,2-Trifluoroacetyl)Amino]Propanoate; (3S)-3-(2-Thienyl)-3-[(2,2,2-Trifluoro-1-Oxoethyl)Amino]Propanoate; (3S)-3-(2-Thienyl)-3-[(2,2,2-Trifluoroacetyl)Amino]Propionate
• Molecular Formula: C₉H₇F₃NO₃S
• Molecular Weight: 266.21
• CAS Registry Number: 115957-22-7
• SMILES: [C@H](NC(=O)C(F)(F)F)(CC([O-])=O)C1=CC=CS1
• InChI: 1S/C9H8F3NO3S/c10-9(11,12)8(16)13-5(4-7(14)15)6-2-1-3-17-6/h1-3,5H,4H2,(H,13,16)(H,14,15)/p-1/t5-/m0/s1
• InChIKey: LAPSEFLUNMVPQL-YFKPBYRVSA-M

Properties

• Boiling point: 411.179°C at 760 mmHg (Cal.)
• Flash point: 202.474°C (Cal.)