1-Benzyl-4-(2-thienyl)-3-pyrrolidinecarboxylic acid
[CAS# 879686-81-4]

Identification

• Name: 1-Benzyl-4-(2-thienyl)-3-pyrrolidinecarboxylic acid
• Synonyms: 1-Benzyl-4-thiophen-2-yl-pyrrolidine-3-carboxylicacid; 3-PYRROLIDINECARBOXYLICACID, 1-(PHENYLMETHYL)-4-(2-THIENYL)-
• Molecular Formula: C₁₆H₁₇NO₂S
• Molecular Weight: 287.38
• CAS Registry Number: 879686-81-4
• SMILES: OC(=O)C2CN(CC2c1cccs1)Cc3ccccc3
• InChI: 1S/C16H17NO2S/c18-16(19)14-11-17(9-12-5-2-1-3-6-12)10-13(14)15-7-4-8-20-15/h1-8,13-14H,9-11H2,(H,18,19)
• InChIKey: WKOQJWXJELLGLA-UHFFFAOYSA-N

Properties

• Density: 1.283g/cm³ (Cal.)
• Boiling point: 457.345°C at 760 mmHg (Cal.)
• Flash point: 230.394°C (Cal.)
• Refractive index: 1.634 (Cal.)