1346604-13-4

Name ALLOPURINOL IMPURITY C
CAS 1346604-13-4
Molecular Formula C6H6N6O
MDL Number MFCD21363439
Molecular Weight 178.15
MOL File 1346604-13-4.mol
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Chemical Properties

Boiling point  579.3±60.0 °C(Predicted)
density  1.85±0.1 g/cm3(Predicted)
storage temp.  2-8°C
solubility  Aqueous Base (Slightly, Heated), DMSO (Slightly)
form  neat
pka 9.36±0.50(Predicted)
Major Application pharmaceutical
InChI InChI=1S/C6H6N6O/c7-5(13)4-1-8-11-6(4)12-2-9-10-3-12/h1-3H,(H2,7,13)(H,8,11)
InChIKey OFCNXPDARWKPPY-UHFFFAOYSA-N
SMILES N1C=C(C(N)=O)C(N2C=NN=C2)=N1

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
RIDADR  UN 3077 9 / PGIII
WGK Germany  WGK 3
HS Code  2933199050
Storage Class 11 - Combustible Solids

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