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CAS Number: 22620-29-7
ethyl 5-fluoronicotinate

Structure

ethyl 5-fluoronicotinate
Name: ethyl 5-fluoronicotinate
Synonyms:
General Information
Product Number: 22620297
CAS Registry Number: 22620-29-7
Name:
        3-​Pyridinecarboxylic acid, 5-​fluoro-​, ethyl ester
        Nicotinic acid, 5-​fluoro-​, ethyl ester (8CI); 5-​Fluoronicotinic acid ethyl ester; Ethyl 5-​fluoronicotinate 
 
Chemical Formula: C8H8FNO2
Exact Mass: 169.05
Molecular Weight: 169.15
m/z: 169.05 (100.0%), 170.06 (8.8%)
Elemental Analysis: C, 56.80; H, 4.77; F, 11.23; N, 8.28; O, 18.92
 
InChI: InChI=1S/C8H8FNO2/c1-2-12-8(11)6-3-7(9)5-10-4-6/h3-5H,2H2,1H3
InChIKey: GAOUAPNRNSFZGW-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CC(=CN=C1)F

Specification

98%

References

PCT Int. Appl. (2012), WO 2012158413 A2 20121122.

PCT Int. Appl. (2005), WO 2005080386 A1 20050901.

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