(3E,4S)-4-(1-Methyl-1H-imidazol-4-yl)-3-(phenylmethylene)-2-Pyrrolidinone
[CAS# 50656-82-1]

Identification

• Name: (3E,4S)-4-(1-Methyl-1H-imidazol-4-yl)-3-(phenylmethylene)-2-Pyrrolidinone
• Synonyms: (3E,4R)-4-(1-Methylimidazol-4-Yl)-3-(Phenylmethylene)Pyrrolidin-2-One; (3E,4R)-4-(1-Methyl-4-Imidazolyl)-3-(Phenylmethylene)-2-Pyrrolidinone; (3E,4R)-3-(Benzylidene)-4-(1-Methylimidazol-4-Yl)-2-Pyrrolidone
• Molecular Formula: C₁₅H₁₅N₃O
• Molecular Weight: 253.30
• CAS Registry Number: 50656-82-1
• SMILES: [C@@H]\1(CNC(=O)C1=C/C2=CC=CC=C2)C3=C[N](C=N3)C
• InChI: 1S/C15H15N3O/c1-18-9-14(17-10-18)13-8-16-15(19)12(13)7-11-5-3-2-4-6-11/h2-7,9-10,13H,8H2,1H3,(H,16,19)/b12-7+/t13-/m0/s1
• InChIKey: UKNFHVAQMUDAFF-WHGQRRHOSA-N

Properties

• Density: 1.234g/cm³ (Cal.)
• Boiling point: 579.384°C at 760 mmHg (Cal.)
• Flash point: 304.201°C (Cal.)