(2R,3R,3aS,9aR)-6-Amino-2-(hydroxymethyl)-2,3,3a,9a-tetrahydro-6H-furo[2',3':4,5][1,3]oxazolo[3,2-a]pyrimidin-3-ol
[CAS# 782400-39-9]

Identification

• Name: (2R,3R,3aS,9aR)-6-Amino-2-(hydroxymethyl)-2,3,3a,9a-tetrahydro-6H-furo[2',3':4,5][1,3]oxazolo[3,2-a]pyrimidin-3-ol
• Synonyms: 2,2'-Anhydrocytidine
• Molecular Formula: C₉H₁₃N₃O₄
• Molecular Weight: 227.22
• CAS Registry Number: 782400-39-9
• SMILES: C1=CN2[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)OC2=NC1N
• InChI: 1S/C9H13N3O4/c10-5-1-2-12-8-7(16-9(12)11-5)6(14)4(3-13)15-8/h1-2,4-8,13-14H,3,10H2/t4-,5?,6-,7+,8-/m1/s1
• InChIKey: CCKNWXBUWLBWKE-RYXNKOGWSA-N

Properties

• Density: 2.0±0.1g/cm³ (Cal.)
• Boiling point: 451.4±55.0°C at 760 mmHg (Cal.)
• Flash point: 226.8±31.5°C (Cal.)
• Refractive index: 1.846 (Cal.)