2039-06-7

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2039-06-7 Structure

Identification	Back Directory
[Name] 3,5-Diphenyl-4H-1,2,4-triazole
[CAS] 2039-06-7
[Synonyms] 50928 JACS-2039-6-7 3,5-Diphenyl-1H-1,2,4-triazole 3,5-Diphenyl-4H-1,2,4-triazole 1H-1,2,4-Triazole, 3,5-diphenyl-
[Molecular Formula] C14H11N3
[MDL Number] MFCD00445312
[MOL File] 2039-06-7.mol
[Molecular Weight] 221.26

Chemical Properties	Back Directory
[Melting point ] 192°C
[Boiling point ] 352.32°C (rough estimate)
[density ] 1.1882 (rough estimate)
[refractive index ] 1.5770 (estimate)
[storage temp. ] Inert atmosphere,Room Temperature
[pka] 9.46±0.40(Predicted)
[Appearance] Off-white to pale purple Solid

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H315-H319-H413
[Precautionary statements ] P501-P273-P264-P280-P337+P313-P305+P351+P338-P302+P352-P332+P313-P362
[Toxicity] mouse,LD50,intraperitoneal,300mg/kg (300mg/kg),LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION,Journal of Pharmaceutical Sciences. Vol. 50, Pg. 597, 1961.

Hazard Information	Back Directory
[Chemical Properties] White solid
[Synthesis Reference(s)] Tetrahedron, 26, p. 2619, 1970 DOI: 10.1016/S0040-4020(01)92836-4

Spectrum Detail	Back Directory
[Spectrum Detail] 3,5-Diphenyl-4H-1,2,4-triazole(2039-06-7)¹HNMR

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