(3R,4S)-3-[(S)-Hydroxy-Phenyl-Methyl]-1-Methyl-4-(1-Methylimidazol-4-Yl)Pyrrolidin-2-One
[CAS# 50656-83-2]

Identification

• Name: (3R,4S)-3-[(S)-Hydroxy-Phenyl-Methyl]-1-Methyl-4-(1-Methylimidazol-4-Yl)Pyrrolidin-2-One
• Synonyms: (3R,4S)-3-[(S)-Hydroxy-Phenyl-Methyl]-1-Methyl-4-(1-Methylimidazol-4-Yl)Pyrrolidin-2-One; (3R,4S)-3-[(S)-Hydroxy-Phenylmethyl]-1-Methyl-4-(1-Methyl-4-Imidazolyl)-2-Pyrrolidinone; (3R,4S)-3-[(S)-Hydroxy-Phenyl-Methyl]-1-Methyl-4-(1-Methylimidazol-4-Yl)-2-Pyrrolidone
• Molecular Formula: C₁₆H₁₉N₃O₂
• Molecular Weight: 285.35
• CAS Registry Number: 50656-83-2
• SMILES: [C@@H]2([C@H](C1=C[N](C)C=N1)CN(C2=O)C)[C@@H](C3=CC=CC=C3)O
• InChI: 1S/C16H19N3O2/c1-18-9-13(17-10-18)12-8-19(2)16(21)14(12)15(20)11-6-4-3-5-7-11/h3-7,9-10,12,14-15,20H,8H2,1-2H3/t12-,14+,15+/m0/s1
• InChIKey: UJMVRXMFOYOOMI-NWANDNLSSA-N

Properties

• Density: 1.275g/cm³ (Cal.)
• Boiling point: 561.075°C at 760 mmHg (Cal.)
• Flash point: 293.128°C (Cal.)