Basic information Safety Supplier Related

3-HYDROXY-5-(TRIFLUOROMETHYL)BENZOIC ACID

Basic information Safety Supplier Related

3-HYDROXY-5-(TRIFLUOROMETHYL)BENZOIC ACID Basic information

Product Name:
3-HYDROXY-5-(TRIFLUOROMETHYL)BENZOIC ACID
Synonyms:
  • 3-Carboxy-5-(trifluoromethyl)phenol, 3-Carboxy-5-hydroxybenzotrifluoride
  • 3-HYDROXY-5-(TRIFLUOROMETHYL)BENZOIC ACID
  • Benzoic acid, 3-hydroxy-5-(trifluoromethyl)-
  • -Carboxy-5-(trifluoromethyl)phenol
CAS:
328-69-8
MF:
C8H5F3O3
MW:
206.12
Product Categories:
  • Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts
Mol File:
328-69-8.mol
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3-HYDROXY-5-(TRIFLUOROMETHYL)BENZOIC ACID Chemical Properties

Melting point:
191-193°C
Boiling point:
333.7±42.0 °C(Predicted)
Density 
1.539±0.06 g/cm3(Predicted)
storage temp. 
Inert atmosphere,Room Temperature
pka
3.65±0.10(Predicted)
Appearance
White to off-white Solid
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Safety Information

Hazard Codes 
Xi
Hazard Note 
Irritant
HS Code 
2918290090
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3-HYDROXY-5-(TRIFLUOROMETHYL)BENZOIC ACID Usage And Synthesis

Synthesis

328-68-7

328-69-8

Step 2: To an aqueous suspension of 3-amino-5-trifluoromethylbenzoic acid (4.36 g, 21.3 mmol) was slowly added concentrated sulfuric acid (10.6 mL, 191 mmol) at 0 °C. The reaction mixture was stirred continuously until the solid was completely dissolved. Subsequently, an aqueous solution (40 mL) of sodium nitrite (1.47 g, 21.3 mmol) was added dropwise. The reaction mixture was continued to be stirred at 0 °C for 15 min, and then warmed up to reflux state maintained for 15 min. Upon completion of the reaction, the mixture was cooled to room temperature and extracted three times with ether. All organic layers were combined, washed with saturated brine and dried over anhydrous magnesium sulfate. The desiccant was removed by filtration and the filtrate was concentrated under reduced pressure to give 3-hydroxy-5-(trifluoromethyl)benzoic acid (25-2, 4.06 g) as a yellow solid.

References

[1] Patent: WO2007/64045, 2007, A1. Location in patent: Page/Page column 341-342
[2] Patent: US2018/312523, 2018, A1. Location in patent: Paragraph 1842; 1844

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