746656-39-3

Name Phenol, 3-(4H-1,2,4-triazol-4-yl)- (9CI)
CAS 746656-39-3
Molecular Formula C8H7N3O
MDL Number MFCD09416955
Molecular Weight 161.16
MOL File 746656-39-3.mol
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Chemical Properties

Melting point  230-231℃ (ethanol )
Boiling point  388.3±44.0 °C(Predicted)
density  1.32±0.1 g/cm3(Predicted)
storage temp.  2-8°C
form  solid
pka 9.22±0.10(Predicted)
InChI 1S/C8H7N3O/c12-8-3-1-2-7(4-8)11-5-9-10-6-11/h1-6,12H
InChIKey HGYDYAJSQGPQKI-UHFFFAOYSA-N
SMILES OC1=CC(N2C=NN=C2)=CC=C1

Safety Data

WGK Germany  WGK 3
HS Code  2933990099
Storage Class 13 - Non Combustible Solids

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