ChemicalBook > CAS DataBase List > 5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid

5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid

Product Name
5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid
CAS No.
1204298-65-6
Chemical Name
5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid
Synonyms
Fluxapyroxad Impurity 3;5-(difluoromethyl)-1-methylpyrazole-4-carboxylic acid;5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid;1H-Pyrazole-4-carboxylic acid, 5-(difluoroMethyl)-1-Methyl-
CBNumber
CB12520220
Molecular Formula
C6H6F2N2O2
Formula Weight
176.12
MOL File
1204298-65-6.mol
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5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid Property

Boiling point:
315.9±42.0 °C(Predicted)
Density 
1.52
storage temp. 
Sealed in dry,Room Temperature
pka
3.12±0.36(Predicted)
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Safety

HS Code 
2933199090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

TRC
Product number
D445348
Product name
5-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylicAcid
Packaging
50mg
Price
$695
Updated
2021/12/16
Apolloscientific
Product number
PC910578
Product name
5-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylicacid
Purity
95%
Packaging
250mg
Price
$185
Updated
2021/12/16
Apolloscientific
Product number
PC910578
Product name
5-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylicacid
Purity
95%
Packaging
1g
Price
$470
Updated
2021/12/16
AK Scientific
Product number
3543AA
Product name
5-(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylicacid
Packaging
1g
Price
$490
Updated
2021/12/16
American Custom Chemicals Corporation
Product number
HCH0054114
Product name
5-(DIFLUOROMETHYL)-1-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID
Purity
95.00%
Packaging
1G
Price
$983.52
Updated
2021/12/16
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5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid Chemical Properties,Usage,Production

Uses

5-(Difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid is a useful reagent in the preparation of fluxapyroxad analogs which are anti-fungal agents.

Synthesis

851725-87-6

176969-34-9

1204298-65-6

The general procedure for the synthesis of 3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid and 5-(difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid using ethyl 3-(dichloromethyl)-1-methyl-1H-pyrazole-4-carboxylate as a raw material was as follows: according to the method of Example 13, 200 g of 3-(dichloromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid ethyl ester (GC purity: 92.8%, 0.783 mol) was added to an autoclave with 69.50 g of 1,3-dimethyl-2-imidazolidinone hexadecyl hydrofluoric acid salt (0.160 mol). The temperature was gradually increased to 130°C to 155°C. When the system temperature reached 130 to 155°C, the reaction was maintained at this temperature range for 7 to 12 hours. Upon completion of the reaction, the pressure was released, purged with nitrogen, and the exhaust gas was treated by alkaline absorption. The reaction mixture was cooled to 60 to 80°C and the reaction solution was diluted by adding 350 g of xylene and 60 g of water. Subsequently, 125.00 g of aqueous sodium hydroxide solution with a mass concentration of 30% (mass concentration refers to the percentage of sodium hydroxide to the total mass of the solution) was slowly added dropwise and stirred at 70°C for 1 hour. The mixture was separated and the aqueous phase was acidified with concentrated hydrochloric acid at a mass concentration of 36% (mass concentration refers to the percentage of hydrogen chloride to the total mass of the concentrated hydrochloric acid) to pH=1.0. Cooled to 10-25°C, filtered and dried under vacuum to give 117.60 g of 3-(difluoromethyl)-1 -methyl-1H-pyrazole-4-carboxylic acid (Yield: 84.5%, HPLC purity: 99.1%; isomer 5 -(Difluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid with HPLC purity of 0.05%).

References

[1] Patent: CN106467492, 2017, A. Location in patent: Paragraph 0224; 0225; 0226; 0227; 0228; 0229; 0230-0235

5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid manufacturers

Career Henan Chemical Co
Product
5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid 1204298-65-6
Price
US $6.60/KG
Min. Order
1KG
Purity
97%-99%
Supply Ability
1kg -1000kg
Release date
2020-01-02

1204298-65-6, 5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acidRelated Search:


  • 1H-Pyrazole-4-carboxylic acid, 5-(difluoroMethyl)-1-Methyl-
  • 5-(difluoromethyl)-1-methyl-1h-pyrazole-4-carboxylic acid
  • 5-(difluoromethyl)-1-methylpyrazole-4-carboxylic acid
  • Fluxapyroxad Impurity 3
  • 1204298-65-6