IUPAC Name: | ethyl 2-(5-bromo-2-fluorophenyl)-2-oxoacetate |
Description: | Ethyl 2-(5-Bromo-2-fluorophenyl)-2-oxoacetate (CAS# 668969-68-4) is a versatile reactant used in the synthesis of a tricyclic BACE1 inhibitor warhead through β-lactam opening. |
Molecular Weight: | 275.07 |
Molecular Formula: | C10H8BrFO3 |
Canonical SMILES: | CCOC(=O)C(=O)C1=C(C=CC(=C1)Br)F |
InChI: | InChI=1S/C10H8BrFO3/c1-2-15-10(14)9(13)7-5-6(11)3-4-8(7)12/h3-5H,2H2,1H3 |
InChI Key: | YMQNEIXEJHZWSB-UHFFFAOYSA-N |
LogP: | 2.33400 |
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Related Functional Groups
Carbonyl Compounds
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
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