167548-89-2

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167548-89-2 Structure

Identification	Back Directory
[Name] 4-(Trifluoromethyl)Thiazole-5-Carboxylic Acid
[CAS] 167548-89-2
[Synonyms] 4-(Trifluoromethyl)Thiazole-5-Carboxylic Acid 5-Thiazolecarboxylic acid, 4-(trifluoromethyl)- 4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid
[Molecular Formula] C5H2F3NO2S
[MDL Number] MFCD14551345
[MOL File] 167548-89-2.mol
[Molecular Weight] 197.14

Chemical Properties	Back Directory
[Boiling point ] 288.3±40.0 °C(Predicted)
[density ] 1.668±0.06 g/cm3(Predicted)
[storage temp. ] 2-8°C
[form ] solid
[pka] 1.80±0.36(Predicted)
[Appearance] White to off-white Solid
[InChI] 1S/C5H2F3NO2S/c6-5(7,8)3-2(4(10)11)12-1-9-3/h1H,(H,10,11)
[InChIKey] LGMYDWYBEAWGAV-UHFFFAOYSA-N
[SMILES] O=C(O)C1=C(N=CS1)C(F)(F)F

Safety Data	Back Directory
[WGK Germany ] WGK 3
[HS Code ] 2934208090
[Storage Class] 11 - Combustible Solids

Spectrum Detail	Back Directory
[Spectrum Detail] 4-(Trifluoromethyl)Thiazole-5-Carboxylic Acid(167548-89-2)¹HNMR 4-(Trifluoromethyl)Thiazole-5-Carboxylic Acid(167548-89-2)¹⁹FNMR

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