142994-06-7

Name 2-METHYLSULFONYL-4-TRIFLUOROMETHYL BENZOIC ACID
CAS 142994-06-7
Molecular Formula C9H7F3O4S
MDL Number MFCD09037774
Molecular Weight 268.21
MOL File 142994-06-7.mol
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Chemical Properties

Melting point  >98oC (dec.)
Boiling point  416.6±45.0 °C(Predicted)
density  1.513
storage temp.  Sealed in dry,2-8°C
solubility  Chloroform (Slightly, Heated), DMSO (Slightly, Heated, Sonicated)
form  Solid
pka 2.02±0.10(Predicted)
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 Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302+H312+H332-H315-H319-H335
Precautionary statements  P261-P280-P305+P351+P338
HS Code  2918999090

Hazard Information

Spectrum Detail

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