1-[3,4-Dihydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-4,7-Dihydro-3H-1,3-Diazepin-2-One
[CAS# 75421-11-3]

Identification

• Name: 1-[3,4-Dihydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-4,7-Dihydro-3H-1,3-Diazepin-2-One
• Synonyms: 1-[3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-4,7-Dihydro-3H-1,3-Diazepin-2-One; 1-[3,4-Dihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-4,7-Dihydro-3H-1,3-Diazepin-2-One; 1-(3,4-Dihydroxy-5-Methylol-Tetrahydrofuran-2-Yl)-4,7-Dihydro-3H-1,3-Diazepin-2-One
• Molecular Formula: C₁₀H₁₆N₂O₅
• Molecular Weight: 244.25
• CAS Registry Number: 75421-11-3
• SMILES: C(O)C2OC(N1C(=O)NCC=CC1)C(O)C2O
• InChI: 1S/C10H16N2O5/c13-5-6-7(14)8(15)9(17-6)12-4-2-1-3-11-10(12)16/h1-2,6-9,13-15H,3-5H2,(H,11,16)
• InChIKey: HBBIVXDEBCKFIZ-UHFFFAOYSA-N

Properties

• Density: 1.462g/cm³ (Cal.)
• Boiling point: 601.12°C at 760 mmHg (Cal.)
• Flash point: 317.346°C (Cal.)