5-(8-Hydroxy-7,8-Dihydro-4H-Imidazo[5,4-d][1,3]Diazepin-3-Yl)-3-(Hydroxymethyl)Cyclopent-3-Ene-1,2-Diol
[CAS# 104493-13-2]

Identification

• Name: 5-(8-Hydroxy-7,8-Dihydro-4H-Imidazo[5,4-d][1,3]Diazepin-3-Yl)-3-(Hydroxymethyl)Cyclopent-3-Ene-1,2-Diol
• Synonyms: 5-(8-Hydroxy-7,8-Dihydro-4H-Imidazo[5,4-D][1,3]Diazepin-3-Yl)-3-Methylol-Cyclopent-3-Ene-1,2-Diol; Om 3223; 3-Cyclopentene-1,2-Diol, 5-(7,8-Dihydro-8-Hydroxyimidazo(4,5-D)(1,3)Diazepin-3(4H)-Yl)-3-(Hydroxymethyl)-
• Molecular Formula: C₁₂H₁₆N₄O₄
• Molecular Weight: 280.28
• CAS Registry Number: 104493-13-2
• SMILES: C1=NC3=C([N]1C2C=C(CO)C(C2O)O)NC=NCC3O
• InChI: 1S/C12H16N4O4/c17-3-6-1-7(11(20)10(6)19)16-5-15-9-8(18)2-13-4-14-12(9)16/h1,4-5,7-8,10-11,17-20H,2-3H2,(H,13,14)
• InChIKey: WJSAFKJWCOMTLH-UHFFFAOYSA-N

Properties

• Density: 1.816g/cm³ (Cal.)
• Boiling point: 652.001°C at 760 mmHg (Cal.)
• Flash point: 348.118°C (Cal.)