2-Phenyl-4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid Structure

2-Phenyl-4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid

Chemical Properties

Melting point 188-190
Boiling point 405.7±55.0 °C(Predicted)
Density  1.489±0.06 g/cm3(Predicted)
pka 1.79±0.36(Predicted)
form  solid
InChI 1S/C11H6F3NO2S/c12-11(13,14)8-7(10(16)17)18-9(15-8)6-4-2-1-3-5-6/h1-5H,(H,16,17)
InChIKey YQIRASZRRDKWSG-UHFFFAOYSA-N
SMILES O=C(O)C(S1)=C(C(F)(F)F)N=C1C2=CC=CC=C2
UNSPSC Code 12352106
NACRES NA.21

Safety

Hazard statements H413
Precautionary statements P273-P501
Hazard Codes  Xi
WGK Germany  WGK 3
Hazard Note  Irritant
HS Code  2934100090
Storage Class 11 - Combustible Solids
Hazard Classifications Aquatic Chronic 4

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