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CAS Number: 318-35-4
ethyl 6-fluoro-4-hydroxyquinoline-2-carboxylate

Structure

ethyl 6-fluoro-4-hydroxyquinoline-2-carboxylate
Name: ethyl 6-fluoro-4-hydroxyquinoline-2-carboxylate
Synonyms:
General Information
Product Number: 318354
CAS Registry Number: 318-35-4
Name:
        3-​Quinolinecarboxylic acid, 6-​fluoro-​4-​hydroxy-​, ethyl ester
        6-​Fluoro-​4-​hydroxyquinoline-​3-​carboxylic acid ethyl ester; Ethyl 6-​fluoro-​4-​hydroxy-​3-​quinolinecarboxylate 
 
Chemical Formula: C12H10FNO3
Exact Mass: 235.06
Molecular Weight: 235.21
m/z: 235.06 (100.0%), 236.07 (13.2%), 237.07 (1.4%)
Elemental Analysis: C, 61.28; H, 4.29; F, 8.08; N, 5.95; O, 20.41
 
InChI: InChI=1S/C12H10FNO3/c1-2-17-12(16)9-6-14-10-4-3-7(13)5-8(10)11(9)15/h3-6H,2H2,1H3,(H,14,15)
InChIKey: LNPRCADPRULVTR-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)F
 
Thermal Properties Value Condition Note
Melting Point 288-289 °C   (5)CAS
Melting Point 269 °C Solv: N,N-dimethylformamide (68-12-2) (6)CAS

Specification

98%

References
  1. (1) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  2. (2) El Ahmad, Youssef; FR 2862301 A1 2005 CAPLUS
  3. (3) Hoeglund, Iisa P. J.; Journal of Medicinal Chemistry 2006, V49(21), P6351-6363 CAPLUS
  4. (4) Eswaran, Sumesh; Bioorganic & Medicinal Chemistry Letters 2010, V20(3), P1040-1044 CAPLUS
  5. (5) Snyder, H. R.; Journal of the American Chemical Society 1947, V69, P371-4 CAPLUS
  6. (6) Gajbhiye, Asmita; Oriental Journal of Chemistry 2007, V23(3), P935-942 CAPLUS
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