(3S,4R)-Dihydro-3-((S)-Hydroxyphenylmethyl)-4-((1-Methyl-1H-Imidazol-4-Yl)Methyl)-2(3H)-Furanone
[CAS# 69460-80-6]

Identification

• Name: (3S,4R)-Dihydro-3-((S)-Hydroxyphenylmethyl)-4-((1-Methyl-1H-Imidazol-4-Yl)Methyl)-2(3H)-Furanone
• Synonyms: (3S,4R)-3-[(S)-Hydroxy-Phenyl-Methyl]-4-[(1-Methylimidazol-4-Yl)Methyl]Tetrahydrofuran-2-One; (3S,4R)-3-[(S)-Hydroxy-Phenylmethyl]-4-[(1-Methyl-4-Imidazolyl)Methyl]-2-Tetrahydrofuranone; (3S,4R)-3-[(S)-Hydroxy-Phenyl-Methyl]-4-[(1-Methylimidazol-4-Yl)Methyl]Oxolan-2-One
• Molecular Formula: C₁₆H₁₈N₂O₃
• Molecular Weight: 286.33
• CAS Registry Number: 69460-80-6
• SMILES: [C@H]1([C@H](COC1=O)CC2=C[N](C=N2)C)[C@H](O)C3=CC=CC=C3
• InChI: 1S/C16H18N2O3/c1-18-8-13(17-10-18)7-12-9-21-16(20)14(12)15(19)11-5-3-2-4-6-11/h2-6,8,10,12,14-15,19H,7,9H2,1H3/t12-,14-,15+/m0/s1
• InChIKey: OLLOSKHCXIYWIO-AEGPPILISA-N

Properties

• Density: 1.299g/cm³ (Cal.)
• Boiling point: 568.305°C at 760 mmHg (Cal.)
• Flash point: 297.5°C (Cal.)