Lorazepam Glucuronide
[CAS# 32781-79-6]

Identification

• Name: Lorazepam Glucuronide
• Synonyms: (2S,3S,4S,5R,6S)-6-[[7-Chloro-5-(2-Chlorophenyl)-2-Oxo-1,3-Dihydro-1,4-Benzodiazepin-3-Yl]Oxy]-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6S)-6-[[7-Chloro-5-(2-Chlorophenyl)-2-Oxo-1,3-Dihydro-1,4-Benzodiazepin-3-Yl]Oxy]-3,4,5-Trihydroxy-2-Tetrahydropyrancarboxylic Acid; (2S,3S,4S,5R,6S)-6-[[7-Chloro-5-(2-Chlorophenyl)-2-Keto-1,3-Dihydro-1,4-Benzodiazepin-3-Yl]Oxy]-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid
• Molecular Formula: C₂₁H₁₈Cl₂N₂O₈
• Molecular Weight: 497.29
• CAS Registry Number: 32781-79-6
• SMILES: [C@@H]4(OC1N=C(C2=C(NC1=O)C=CC(=C2)Cl)C3=CC=CC=C3Cl)O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(=O)O
• InChI: 1S/C21H18Cl2N2O8/c22-8-5-6-12-10(7-8)13(9-3-1-2-4-11(9)23)25-19(18(29)24-12)33-21-16(28)14(26)15(27)17(32-21)20(30)31/h1-7,14-17,19,21,26-28H,(H,24,29)(H,30,31)/t14-,15-,16+,17-,19?,21-/m0/s1
• InChIKey: IWOJSSFCRQKNKN-IFBJMGMISA-N

Properties

• Density: 1.77g/cm³ (Cal.)
• Boiling point: 779.518°C at 760 mmHg (Cal.)
• Flash point: 425.237°C (Cal.)