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CAS Number: 122433-41-4
methyl 5-bromo-2-methoxynicotinate

Structure

methyl 5-bromo-2-methoxynicotinate
Name: methyl 5-bromo-2-methoxynicotinate
Synonyms:
General Information
Product Number: 122433414

CAS Registry Number: 122433-41-4

Name:

3-​Pyridinecarboxylic acid, 5-​bromo-​2-​methoxy-​, methyl ester
Methyl 5-​bromo-​2-​(methyloxy)​-​3-​pyridinecarboxylate; Methyl 5-​bromo-​2-​methoxypyridine-​3-​carboxylate 

 

Chemical Formula: C8H8BrNO3
Exact Mass: 244.97
Molecular Weight: 246.06
m/z: 244.97 (100.0%), 246.97 (97.9%), 245.97 (9.1%), 247.97 (8.6%)
Elemental Analysis: C, 39.05; H, 3.28; Br, 32.47; N, 5.69; O, 19.51

 

InChI: InChI=1S/C8H8BrNO3/c1-12-7-6(8(11)13-2)3-5(9)4-10-7/h3-4H,1-2H3
InChIKey: OLQOVEOEHQDKSC-UHFFFAOYSA-N
Canonical SMILES : COC1=NC=C(C=C1C(=O)OC)Br

 

Specification

98%

References
  1. (1) Sarges, Reinhard; Journal of Medicinal Chemistry 1990, V33(7), P1859-65 CAPLUS
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