1-(2-O-Nitro-beta-D-Arabinofuranosyl)Cytosine
[CAS# 83831-64-5]

Identification

• Name: 1-(2-O-Nitro-beta-D-Arabinofuranosyl)Cytosine
• Synonyms: [(2R,3S,4R,5R)-2-(4-Amino-2-Oxo-Pyrimidin-1-Yl)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-3-Yl] Nitrate; Nitric Acid [(2R,3S,4R,5R)-2-(4-Amino-2-Oxo-1-Pyrimidinyl)-4-Hydroxy-5-(Hydroxymethyl)-3-Tetrahydrofuranyl] Ester; Nitric Acid [(2R,3S,4R,5R)-2-(4-Amino-2-Keto-Pyrimidin-1-Yl)-4-Hydroxy-5-Methylol-Tetrahydrofuran-3-Yl] Ester
• Molecular Formula: C₉H₁₂N₄O₇
• Molecular Weight: 288.22
• CAS Registry Number: 83831-64-5
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@@H]1O[N+]([O-])=O)CO)N2C(=O)N=C(N)C=C2
• InChI: 1S/C9H12N4O7/c10-5-1-2-12(9(16)11-5)8-7(20-13(17)18)6(15)4(3-14)19-8/h1-2,4,6-8,14-15H,3H2,(H2,10,11,16)/t4-,6-,7+,8-/m1/s1
• InChIKey: JOHUQOHTIZCLLJ-CCXZUQQUSA-N

Properties

• Density: 2.015g/cm³ (Cal.)
• Boiling point: 572.405°C at 760 mmHg (Cal.)
• Flash point: 299.98°C (Cal.)