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CAS Number: 111493-74-4
ethyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate

Structure

ethyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
Name: ethyl 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
Synonyms:
General Information
Product Number: 111493744
CAS Registry Number: 111493-74-4
Name:
1H-​Pyrazole-​4-​carboxylic acid, 1-​methyl-​3-​(trifluoromethyl)​-​, ethyl ester
1-​Methyl-​3-​(trifluoromethyl)​-​1H-​pyrazole-​4-​carboxylic acid ethyl ester; 1-​Methyl-​3-​trifluoromethylpyraz​ole-​4-​carboxylic acid ethyl ester; Ethyl 1-​methyl-​3-​trifluoromethyl-​1H-​pyrazole-​4-​carboxylate; Ethyl 1-​methyl-​3-​trifluoromethyl-​4-​pyrazolecarboxylate; Ethyl 3-​(trifluoromethyl)​-​1-​methyl-​1H-​pyrazole-​4-​carboxylate; Ethyl 3-​(trifluoromethyl)​-​1-​methyl-​7H-​pyrazole-​4-​carboxylate 
 
Chemical Formula: C8H9F3N2O2
Exact Mass: 222.06
Molecular Weight: 222.16
m/z: 222.06 (100.0%), 223.06 (9.4%)
Elemental Analysis: C, 43.25; H, 4.08; F, 25.65; N, 12.61; O, 14.40
 
InChI: InChI=1S/C8H9F3N2O2/c1-3-15-7(14)5-4-13(2)12-6(5)8(9,10)11/h4H,3H2,1-2H3
InChIKey: ZZEXDJGNURSJOF-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CN(N=C1C(F)(F)F)C

Specification

98%

References

PCT Int. Appl. (2014), WO 2014038224 A1 20140313.

PCT Int. Appl. (2012), WO 2012163905 A1 20121206. 

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