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2039-06-7

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2039-06-7 Structure

2039-06-7 Structure
IdentificationBack 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 PropertiesBack 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 DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
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 InformationBack Directory
[Chemical Properties]

White solid
[Synthesis Reference(s)]

Tetrahedron, 26, p. 2619, 1970 DOI: 10.1016/S0040-4020(01)92836-4
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-Diphenyl-4H-1,2,4-triazole(2039-06-7)1HNMR
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