2'-Deoxy-3',5'-Di-O-Nitro-3,4-Dihydrothymidine
[CAS# 19204-90-1]

Identification

• Name: 2'-Deoxy-3',5'-Di-O-Nitro-3,4-Dihydrothymidine
• Synonyms: Thymidine-3',5'-dinitrate
• Molecular Formula: C₁₀H₁₂N₄O₉
• Molecular Weight: 332.22
• CAS Registry Number: 19204-90-1
• SMILES: CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO[N+](=O)[O-])O[N+](=O)[O-]
• InChI: 1S/C10H12N4O9/c1-5-3-12(10(16)11-9(5)15)8-2-6(23-14(19)20)7(22-8)4-21-13(17)18/h3,6-8H,2,4H2,1H3,(H,11,15,16)/t6-,7+,8+/m0/s1
• InChIKey: GJQPUXKRIHAHJH-XLPZGREQSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Refractive index: 1.597 (Cal.)