IUPAC Name: | ethyl 3-(5-bromo-2-fluorophenyl)-3-oxopropanoate |
Description: | Ethyl (5-bromo-2-fluorobenzoyl)acetate (CAS# 1020058-47-2) is a reactant used in the preparation of 4-Oxo-1-aryl-1,4-dihydroquinoline-3-carboxamides as selective negative allosteric modulators of metabotropic glutamate receptor subtype 2. |
Molecular Weight: | 289.10 |
Molecular Formula: | C11H10BrFO3 |
Canonical SMILES: | CCOC(=O)CC(=O)C1=C(C=CC(=C1)Br)F |
InChI: | InChI=1S/C11H10BrFO3/c1-2-16-11(15)6-10(14)8-5-7(12)3-4-9(8)13/h3-5H,2,6H2,1H3 |
InChI Key: | XODIHCQWLRSGQI-UHFFFAOYSA-N |
MDL: | MFCD09991886 |
LogP: | 2.72410 |
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Related Functional Groups
Carbonyl Compounds
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
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