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CAS Number: 597532-36-0
ethyl 6-(trifluoromethyl)nicotinate

Structure

ethyl 6-(trifluoromethyl)nicotinate
Name: ethyl 6-(trifluoromethyl)nicotinate
Synonyms:
General Information
Product Number: 597532360
CAS Registry Number: 597532-36-0
Name:
3-​Pyridinecarboxylic acid, 6-​(trifluoromethyl)​-​, ethyl ester
6-​Trifluoromethylnicot​inic acid ethyl ester; Ethyl 6-​trifluoromethylnicot​inate 
 
Chemical Formula: C9H8F3NO2
Exact Mass: 219.05
Molecular Weight: 219.16
m/z: 219.05 (100.0%), 220.05 (10.2%)
Elemental Analysis: C, 49.32; H, 3.68; F, 26.01; N, 6.39; O, 14.60
 
InChI: InChI=1S/C9H8F3NO2/c1-2-15-8(14)6-3-4-7(13-5-6)9(10,11)12/h3-5H,2H2,1H3
InChIKey: NRFRJTLIEGYCOA-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CN=C(C=C1)C(F)(F)F

Specification

98%

References

PCT Int. Appl. (2012), WO 2012101066 A1 20120802.                                 

PCT Int. Appl. (2012), WO 2012101064 A1 20120802. 

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