5399-87-1

Name 6-Chloropurine riboside
CAS 5399-87-1
EINECS(EC#) 217-904-8
Molecular Formula C10H11ClN4O4
MDL Number MFCD00005738
Molecular Weight 286.67
MOL File 5399-87-1.mol
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Chemical Properties

Appearance Colourless Crystalline Powder
Melting point  158-162 °C (dec.) (lit.)
Boiling point  614.8±65.0 °C(Predicted)
density  2.03±0.1 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO (Sparingly, Heated), Methanol (Slightly, Heated), Water (Slightly, Heated,
form  Powder
pka 13.06±0.70(Predicted)
color  White to slightly yellow
Water Solubility  Soluble in water. (10.6 mg/mL)
Usage A substrate for adenosine deaminase
BRN  40573
InChI InChI=1/C10H11ClN4O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2/t4-,6-,7-,10-/s3
InChIKey XHRJGHCQQPETRH-HMEJCUHCSA-N
SMILES OC[C@H]1O[C@@H](N2C3=C(C(Cl)=NC=N3)N=C2)[C@H](O)[C@@H]1O |&1:2,4,15,17,r|
CAS DataBase Reference 5399-87-1(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Safety Statements 
S24/25:Avoid contact with skin and eyes .
WGK Germany  3
RTECS  UO7520800
F  10-23
HS Code  29349990

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