5097-86-9

Name 4-(4-Chlorophenyl)-1H-1,2,4-triazol-5(4H)-one
CAS 5097-86-9
Molecular Formula C8H6ClN3O
MDL Number MFCD11053882
Molecular Weight 195.61
MOL File 5097-86-9.mol
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Chemical Properties

Melting point  200 °C
density  1.49±0.1 g/cm3(Predicted)
pka 9.05±0.20(Predicted)
InChI InChI=1S/C8H6ClN3O/c9-6-1-3-7(4-2-6)12-5-10-11-8(12)13/h1-5H,(H,11,13)
InChIKey PMXUOAFWKPAZIG-UHFFFAOYSA-N
SMILES N1=CN(C2=CC=C(Cl)C=C2)C(=O)N1

Safety Data

HS Code  2933998090

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