1-(4-Ethoxy-Benzoyl)-Pyrrolidine-2-Carboxylic Acid
[CAS# 436811-16-4]

Identification

• Name: 1-(4-Ethoxy-Benzoyl)-Pyrrolidine-2-Carboxylic Acid
• Synonyms: (2S)-1-(4-Ethoxyphenyl)Carbonylpyrrolidine-2-Carboxylate; Zinc00332699; (2S)-1-[(4-Ethoxyphenyl)-Oxomethyl]-2-Pyrrolidinecarboxylate
• Molecular Formula: C₁₄H₁₆NO₄
• Molecular Weight: 262.28
• CAS Registry Number: 436811-16-4
• SMILES: [C@@H]2(N(C(=O)C1=CC=C(OCC)C=C1)CCC2)C([O-])=O
• InChI: 1S/C14H17NO4/c1-2-19-11-7-5-10(6-8-11)13(16)15-9-3-4-12(15)14(17)18/h5-8,12H,2-4,9H2,1H3,(H,17,18)/p-1/t12-/m0/s1
• InChIKey: XBFYBYXKIUSYHL-LBPRGKRZSA-M

Properties

• Boiling point: 483.856°C at 760 mmHg (Cal.)
• Flash point: 246.427°C (Cal.)