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Methyl 3-chloro-4-fluorobenzoate

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Methyl 3-chloro-4-fluorobenzoate Basic information

Product Name:
Methyl 3-chloro-4-fluorobenzoate
Synonyms:
  • Chloro-4-fluorobenzoate
  • methyl 3-Chloro-6-fluorobenzoate
  • 3-Chloro-4-fluoro Methyl benzoate
  • Benzoic acid, 3-chloro-4-fluoro-, methyl ester
  • methyl 3-chloro-4-fluorobenzoate
CAS:
234082-35-0
MF:
C8H6ClFO2
MW:
188.58
Mol File:
234082-35-0.mol
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Methyl 3-chloro-4-fluorobenzoate Chemical Properties

Boiling point:
238℃
Density 
1.314
Flash point:
102℃
storage temp. 
Sealed in dry,Room Temperature
Appearance
White to off-white Solid-Liquid Mixture
InChI
InChI=1S/C8H6ClFO2/c1-12-8(11)5-2-3-7(10)6(9)4-5/h2-4H,1H3
InChIKey
RUTYNTBIMOCJMW-UHFFFAOYSA-N
SMILES
C(OC)(=O)C1=CC=C(F)C(Cl)=C1
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Safety Information

HS Code 
2916310090
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Methyl 3-chloro-4-fluorobenzoate Usage And Synthesis

Chemical Properties

off-white powder

Uses

Methyl 3-chloro-4-fluorobenzoate is a halogenated organic compound that could be used as a pharmaceutical intermediate in pharmaceutical synthesis and scientific research.

Synthesis

67-56-1

65055-17-6

234082-35-0

Example 1 Preparation of methyl 3-chloro-4-fluorobenzoate In a 250 mL four-necked round-bottomed flask assembled with a mechanical stirrer, condenser tube and thermometer, 86.5 g of 3-chloro-4-fluorobenzoyl chloride was added. 28.1 g of anhydrous methanol was added slowly through a constant pressure dropping funnel. The reaction was exothermic and the temperature was raised to 60 °C spontaneously. The titration rate of methanol was controlled to maintain the reaction temperature at about 60 °C. The reaction mixture was stirred for 1 hour and the excess methanol was removed by distillation. A final 80 g of yellow oily material was obtained as methyl 3-chloro-4-fluorobenzoate in 97.29% yield.

References

[1] Patent: WO2003/95417, 2003, A1. Location in patent: Page/Page column 6

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