4-Chloro-5-iodo-7-(beta-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine
[CAS# 873792-94-0]

Identification

• Name: 4-Chloro-5-iodo-7-(beta-D-ribofuranosyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine
• Molecular Formula: C₁₁H₁₂ClIN₄O₄
• Molecular Weight: 426.59
• CAS Registry Number: 873792-94-0
• SMILES: Clc3nc(nc1c3c(I)cn1[C@@H]2O[C@@H]([C@@H](O)[C@H]2O)CO)N
• InChI: 1S/C11H12ClIN4O4/c12-8-5-3(13)1-17(9(5)16-11(14)15-8)10-7(20)6(19)4(2-18)21-10/h1,4,6-7,10,18-20H,2H2,(H2,14,15,16)/t4-,6-,7-,10-/m1/s1
• InChIKey: RYFLMNAAVNGVRF-KQYNXXCUSA-N

Properties

• Density: 2.563g/cm³ (Cal.)
• Boiling point: 751.242°C at 760 mmHg (Cal.)
• Flash point: 408.137°C (Cal.)
• Refractive index: 1.922 (Cal.)