2'-Amino-2'Deoxy-2-Chloroinosine
[CAS# 76727-51-0]

Identification

• Name: 2'-Amino-2'Deoxy-2-Chloroinosine
• Synonyms: 9-[(2R,3R,4S,5R)-3-Amino-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-2-Chloro-3H-Purin-6-One; 9-[(2R,3R,4S,5R)-3-Amino-4-Hydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-2-Chloro-3H-Purin-6-One; 9-[(2R,3R,4S,5R)-3-Amino-4-Hydroxy-5-Methylol-Tetrahydrofuran-2-Yl]-2-Chloro-3H-Purin-6-One
• Molecular Formula: C₁₀H₁₂ClN₅O₄
• Molecular Weight: 301.69
• CAS Registry Number: 76727-51-0
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H]1N)CO)[N]2C3=C(N=C2)C(=O)N=C(Cl)N3
• InChI: 1S/C10H12ClN5O4/c11-10-14-7-5(8(19)15-10)13-2-16(7)9-4(12)6(18)3(1-17)20-9/h2-4,6,9,17-18H,1,12H2,(H,14,15,19)/t3-,4-,6-,9-/m1/s1
• InChIKey: YCJHMUMFXXZXNK-DXTOWSMRSA-N

Properties

• Density: 2.194g/cm³ (Cal.)
• Boiling point: 713.373°C at 760 mmHg (Cal.)
• Flash point: 385.234°C (Cal.)