3-(2-Benzylcarbamoyl-Ethyl)-6-Oxo-Piperidine-3-Carboxylic Acid
[CAS# 361372-43-2]

Identification

• Name: 3-(2-Benzylcarbamoyl-Ethyl)-6-Oxo-Piperidine-3-Carboxylic Acid
• Synonyms: (3S)-6-Oxo-3-[3-Oxo-3-(Phenylmethylamino)Propyl]-3-Piperidinecarboxylate; (3S)-3-[3-(Benzylamino)-3-Keto-Propyl]-6-Keto-Nipecotate; Zinc00053601
• Molecular Formula: C₁₆H₁₉N₂O₄
• Molecular Weight: 303.34
• CAS Registry Number: 361372-43-2
• SMILES: [C@@]1(C([O-])=O)(CNC(=O)CC1)CCC(=O)NCC2=CC=CC=C2
• InChI: 1S/C16H20N2O4/c19-13(17-10-12-4-2-1-3-5-12)6-8-16(15(21)22)9-7-14(20)18-11-16/h1-5H,6-11H2,(H,17,19)(H,18,20)(H,21,22)/p-1/t16-/m1/s1
• InChIKey: KFUNZJUZXYJCRY-MRXNPFEDSA-M

Properties

• Boiling point: 660.17°C at 760 mmHg (Cal.)
• Flash point: 353.058°C (Cal.)