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CAS Number: 82671-03-2
ethyl 2,6-dichloro-5-fluoronicotinate

Structure

ethyl 2,6-dichloro-5-fluoronicotinate
Name: ethyl 2,6-dichloro-5-fluoronicotinate
Synonyms:
General Information
Product Number: 82671032
CAS Registry Number: 82671-03-2
Name:
3-​Pyridinecarboxylic acid, 2,​6-​dichloro-​5-​fluoro-​, ethyl ester
2,​6-​Dichloro-​5-​fluoronicotinic acid ethyl ester; Ethyl 2,​6-​dichloro-​5-​fluoronicotinate 
 
Chemical Formula: C8H6Cl2FNO2
Exact Mass: 236.98
Molecular Weight: 238.04
m/z: 236.98 (100.0%), 238.97 (63.9%), 240.97 (10.2%), 237.98 (8.8%), 239.98 (5.7%)
Elemental Analysis: C, 40.36; H, 2.54; Cl, 29.79; F, 7.98; N, 5.88; O, 13.44
 
InChI: InChI=1S/C8H6Cl2FNO2/c1-2-14-8(13)4-3-5(11)7(10)12-6(4)9/h3H,2H2,1H3
InChIKey: FPPLCOWQBGOFDU-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CC(=C(N=C1Cl)Cl)F
 
Thermal Properties Value Condition Note
Boiling Point 95-97 °C Press: 2 Torr (1)IC

Specification

98%

References
  1. (1) Miyamoto, Teruyuki; Chemical & Pharmaceutical Bulletin 1987, V35(6), P2280-5 CAPLUS
  2. (2) JP 57072981 A 1982 CAPLUS
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