(3R,4S)-1-Benzyl-4-(2-fluorophenyl)-3-pyrrolidinecarboxylic acid
[CAS# 874990-50-8]

Identification

• Name: (3R,4S)-1-Benzyl-4-(2-fluorophenyl)-3-pyrrolidinecarboxylic acid
• Synonyms: (4S,3R)-4-(2-fluorophenyl)-1-benzylpyrrolidine-3-carboxylic acid; Trans-1-benzyl-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid
• Molecular Formula: C₁₈H₁₈FNO₂
• Molecular Weight: 299.34
• CAS Registry Number: 874990-50-8
• SMILES: c1ccc(cc1)CN2C[C@@H]([C@H](C2)C(=O)O)c3ccccc3F
• InChI: 1S/C18H18FNO2/c19-17-9-5-4-8-14(17)15-11-20(12-16(15)18(21)22)10-13-6-2-1-3-7-13/h1-9,15-16H,10-12H2,(H,21,22)/t15-,16+/m1/s1
• InChIKey: DXSKJHNQDSNIJN-CVEARBPZSA-N

Properties

• Density: 1.254g/cm³ (Cal.)
• Boiling point: 433.443°C at 760 mmHg (Cal.)
• Flash point: 215.939°C (Cal.)
• Refractive index: 1.601 (Cal.)