5-BroMoquinoline-8-carboxylic acid
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5-BroMoquinoline-8-carboxylic acid
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CAS No:
928839-62-7
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Formula:
C10H6BrNO2
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Chemical Name:
5-BroMoquinoline-8-carboxylic acid
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Synonyms:
5-Bromoquinoline-8-carboxylic acid;8-Quinolinecarboxylic acid, 5-bromo-;SCHEMBL1126280;CTK8B5684;KS-00000OIF;DTXSID10731459;5-bromo-quinoline-8-carboxylic acid;ANW-49599;ZINC72187469;AKOS016001750
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CAS No:
5-BroMoquinoline-8-carboxylic acid Use and Manufacturing
Step 2: S-bromoquinoline-S-carboxylic acidA solution (0.1 M) of 5-bromo-8-methylquinoline (from Step 1) in H2SOzrH2O (3:2) was treated with Cr'3 (10 eq.) at 900C. The reaction mixture was heated at 900C for 2 h. Then, the mixture was poured into ice and the precipitate was filtered affording (62percent) the title compound as an orange solid; MS (ES+) m/z 252, 254 (M+H)+.Step 2: S-bromoquinoline-S-carboxylic acidA solution (0.1 M) of 5-bromo-8-methylquinoline (from Step 1) in H2SOzrH2O (3:2) was treated with Cr'3 (10 eq.) at 900C. The reaction mixture was heated at 900C for 2 h. Then, the mixture was poured into ice and the precipitate was filtered affording (62percent) the title compound as an orange solid; MS (ES+) m/z 252, 254 (M+H)+.
Computed Properties
Molecular Weight:252.06
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:250.95819
Monoisotopic Mass:250.95819
Topological Polar Surface Area:50.2
Heavy Atom Count:14
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-BroMoquinoline-8-carboxylic acid
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