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2-Methylsulfonyl-4-trifluoromethyl benzoic acid Structure

2-Methylsulfonyl-4-trifluoromethyl benzoic acid

Chemical Properties

Melting point >98oC (dec.)
Boiling point 416.6±45.0 °C(Predicted)
Density  1.513
storage temp.  2-8°C
solubility  Chloroform (Slightly, Heated), DMSO (Slightly, Heated, Sonicated)
pka 2.02±0.10(Predicted)
form  Solid
color  Off-White to Light Beige
Stability Hygroscopic
InChI InChI=1S/C9H7F3O4S/c1-17(15,16)7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)
InChIKey OGYBDKOCZVSHQI-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC=C(C(F)(F)F)C=C1S(C)(=O)=O
EPA Substance Registry System 2-(Methylsulfonyl)-4-(trifluoromethyl)benzoic acid (142994-06-7)

Safety Information

HS Code  2918999090

Usage And Synthesis

2-Methylsulfonyl-4-trifluoromethyl benzoic acid Supplier