(3S)-1-(2,4-Dimethylphenyl)-5-Oxopyrrolidine-3-Carboxylic Acid
[CAS# 133748-22-8]

Identification

• Name: (3S)-1-(2,4-Dimethylphenyl)-5-Oxopyrrolidine-3-Carboxylic Acid
• Synonyms: (3S)-1-(2,4-Dimethylphenyl)-5-Oxo-Pyrrolidine-3-Carboxylate; (3S)-1-(2,4-Dimethylphenyl)-5-Oxo-3-Pyrrolidinecarboxylate; (3S)-1-(2,4-Dimethylphenyl)-5-Keto-Pyrrolidine-3-Carboxylate
• Molecular Formula: C₁₃H₁₄NO₃
• Molecular Weight: 232.26
• CAS Registry Number: 133748-22-8
• SMILES: [C@H]1(CN(C(=O)C1)C2=C(C=C(C=C2)C)C)C([O-])=O
• InChI: 1S/C13H15NO3/c1-8-3-4-11(9(2)5-8)14-7-10(13(16)17)6-12(14)15/h3-5,10H,6-7H2,1-2H3,(H,16,17)/p-1/t10-/m0/s1
• InChIKey: QFVVRJNKLKAZNY-JTQLQIEISA-M

Properties

• Boiling point: 535.198°C at 760 mmHg (Cal.)
• Flash point: 277.478°C (Cal.)