8-Chloroadenosine-3',5'-O-Monophosphate
[CAS# 41941-56-4]

Identification

• Name: 8-Chloroadenosine-3',5'-O-Monophosphate
• Synonyms: 8-(6-Amino-8-Chloro-Purin-9-Yl)-3-Hydroxy-3-Oxo-2,4,7-Trioxa-3$L^{5}-Phosphabicyclo[4.3.0]Nonan-9-Ol; 8-(6-Amino-8-Chloro-9-Purinyl)-3-Hydroxy-3-Oxo-2,4,7-Trioxa-3$L^{5}-Phosphabicyclo[4.3.0]Nonan-9-Ol; 8-(6-Amino-8-Chloro-Purin-9-Yl)-3-Hydroxy-3-Keto-2,4,7-Trioxa-3$L^{5}-Phosphabicyclo[4.3.0]Nonan-9-Ol
• Molecular Formula: C₁₀H₁₁ClN₅O₆P
• Molecular Weight: 363.65
• CAS Registry Number: 41941-56-4
• SMILES: C1=NC2=C(C(=N1)N)N=C([N]2C4C(C3O[P](O)(=O)OCC3O4)O)Cl
• InChI: 1S/C10H11ClN5O6P/c11-10-15-4-7(12)13-2-14-8(4)16(10)9-5(17)6-3(21-9)1-20-23(18,19)22-6/h2-3,5-6,9,17H,1H2,(H,18,19)(H2,12,13,14)
• InChIKey: CLLFEJLEDNXZNR-UHFFFAOYSA-N

Properties

• Density: 2.554g/cm³ (Cal.)
• Boiling point: 731.741°C at 760 mmHg (Cal.)
• Flash point: 396.343°C (Cal.)