53645-95-7

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53645-95-7 Structure

Identification	Back Directory
[Name] 2-BROMO-5-PHENYL-1,3,4-THIADIAZOLE
[CAS] 53645-95-7
[Synonyms] 1,3,4-Thiadiazole,2-broMo-5-phenyl- 2-Bromo-5-phenyl-1,3,4-thiadiazole 97%
[Molecular Formula] C8H5BrN2S
[MDL Number] MFCD08436697
[MOL File] 53645-95-7.mol
[Molecular Weight] 241.11

Chemical Properties	Back Directory
[Melting point ] 86-90 °C
[Boiling point ] 125-130 °C(Press: 0.4 Torr)
[density ] 1.642±0.06 g/cm3(Predicted)
[form ] powder
[pka] -1.88±0.10(Predicted)
[InChI] InChI=1S/C8H5BrN2S/c9-8-11-10-7(12-8)6-4-2-1-3-5-6/h1-5H
[InChIKey] NVQXBSUUWVZRCA-UHFFFAOYSA-N
[SMILES] S1C(C2=CC=CC=C2)=NN=C1Br

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H302-H315-H319-H335
[Precautionary statements ] P261-P264-P270-P301+P312-P302+P352-P305+P351+P338
[Hazard Codes ] Xn
[Risk Statements ] 22-36/37/38
[Safety Statements ] 26
[RIDADR ] UN 2811 6.1 / PGIII
[WGK Germany ] 3
[HS Code ] 2934999090

Spectrum Detail	Back Directory
[Spectrum Detail] 2-BROMO-5-PHENYL-1,3,4-THIADIAZOLE(53645-95-7)¹HNMR

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