| CAS Number: 56824-90-9 ethyl 4-chloro-8-fluoroquinoline-3-carboxylate |
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| General Information | ||||||
| Product Number: 56824909
CAS Registry Number: 56824-90-9
Name:
3-Quinolinecarboxylic acid, 4-chloro-8-fluoro-, ethyl ester
4-Chloro-8-fluoroquinoline-3-carboxylic acid ethyl ester; Ethyl 4-chloro-8-fluoroquinoline-3-carboxylate
Chemical Formula: C12H9ClFNO2
Exact Mass: 253.03
Molecular Weight: 253.66
m/z: 253.03 (100.0%), 255.03 (32.4%), 254.03 (13.4%), 256.03 (4.2%)
Elemental Analysis: C, 56.82; H, 3.58; Cl, 13.98; F, 7.49; N, 5.52; O, 12.61
InChI: InChI=1S/C12H9ClFNO2/c1-2-17-12(16)8-6-15-11-7(10(8)13)4-3-5-9(11)14/h3-6H,2H2,1H3
InChIKey: RZBUGOGXQRAHCR-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CN=C2C(=C1Cl)C=CC=C2F
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Specification |
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98% |
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| References | ||||||
PCT Int. Appl. (2014), WO 2014066506 A2 20140501. PCT Int. Appl. (2012), WO 2012158435 A1 20121122. |
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