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ChemicalBook--->CAS DataBase List--->113100-53-1

113100-53-1

113100-53-1 Structure

113100-53-1 Structure
IdentificationBack Directory
[Name]

1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
[CAS]

113100-53-1
[Synonyms]

-3-(trifL
)-1H-pyrazoL
BUTTPARK 99\18-24
1H-Pyrazole-4-carboxylic acid, 1-methyl-3-
4-Carboxy-1-methyl-3-(trifluoromethyl)-1H-pyrazole
1-Methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxy
1-Methyl-3-trifluoromethyl-4-pyrazolecarboxylic Acid
1-METHYL-3-TRIFLUOROMETHYLPYRAZOLE-4-CARBOXYLIC ACID
2-Methyl-5-trifluoromethyl-2H-pyrazole-3-carbonylchloride
1-Methyl-3-(trifluoromethyl)-1H-pyrazol-4-carboxylic acid
1-Methyl-3-(trifluoromethyl)pyrazole-4-carboxylic Acid >
3-(TrifluoroMethyl)-1-Methyl-1H-pyrazole-4-carboxylic acid
1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLIC ACID
1H-Pyrazole-4-carboxylic acid, 1-methyl-3-(trifluoromethyl)-
3-(Trifluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic acid 97%
1-Methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid ,97%
[EINECS(EC#)]

601-232-0
[Molecular Formula]

C6H5F3N2O2
[MDL Number]

MFCD01936005
[MOL File]

113100-53-1.mol
[Molecular Weight]

194.11
Chemical PropertiesBack Directory
[Melting point ]

203 °C
[Boiling point ]

285.6±40.0 °C(Predicted)
[density ]

1.56±0.1 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

2.93±0.36(Predicted)
[color ]

White to Off-White
[InChIKey]

FZNKJQNEJGXCJH-UHFFFAOYSA-N
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36/37/39-24/25
[WGK Germany ]

2
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29331990
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Sodium hydroxide-->Methanol-->Diethyl ether-->Tetrahydrofuran-->Government regulation-->Acetic anhydride-->Hexane-->Iron-->Triethyl orthoformate-->Carbon dioxide-->Trifluoroacetic acid-->Sodium thiosulfate-->4-Dimethylaminopyridine-->Methylhydrazine-->Pentane-->Ethyl 4,4,4-trifluoroacetoacetate-->Ethyl vinyl ether-->tert-Butyllithium
Hazard InformationBack Directory
[Chemical Properties]

White solid
[Uses]

3-(Trifluoromethyl)-1-methyl-1H-pyrazole-4-carboxylic Acid is used in the synthesis of diaryl ether inhibitors of Toxoplasma gondii enoyl reductase. Also used in the synthesis of 4-carboxamide derivatives acting as antifungal agents.
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