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CAS Number: 107555-38-4
ethyl 6,8-difluoro-4-hydroxyquinoline-3-carboxylate

Structure

ethyl 6,8-difluoro-4-hydroxyquinoline-3-carboxylate
Name: ethyl 6,8-difluoro-4-hydroxyquinoline-3-carboxylate
Synonyms:
General Information
Product Number: 107555384
CAS Registry Number: 107555-38-4
Name:
3-​Quinolinecarboxylic acid, 6,​8-​difluoro-​4-​hydroxy-​, ethyl ester
 
Chemical Formula: C12H9F2NO3
Exact Mass: 253.06
Molecular Weight: 253.20
m/z: 253.06 (100.0%), 254.06 (13.2%), 255.06 (1.5%)
Elemental Analysis: C, 56.92; H, 3.58; F, 15.01; N, 5.53; O, 18.96
 
InChI: InChI=1S/C12H9F2NO3/c1-2-18-12(17)8-5-15-10-7(11(8)16)3-6(13)4-9(10)14/h3-5H,2H2,1H3,(H,15,16)
InChIKey: NUHKASXLPYOGHW-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CNC2=C(C=C(C=C2C1=O)F)F
 
Thermal Properties Value Condition Note
Melting Point 275-277 °C Solv: ethanol (64-17-5) (1)IC

Specification

98%

References
  1. (1) Krishnan, Raghavan; Journal of Pharmaceutical Sciences 1986, V75(12), P1185-7 CAPLUS
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