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CAS Number: 29681-44-5
methyl 5-bromonicotinate

Structure

 methyl 5-bromonicotinate
Name: methyl 5-bromonicotinate
Synonyms:
General Information
Product Number: 29681445

CAS Registry Number 29681-44-5
Name:
3-?Pyridinecarboxylic acid, 5-?bromo-?, methyl ester
Nicotinic acid, 5-bromo-, methyl ester (7CI,8CI)
5-Bromonicotinic acid methyl ester
5-Bromopyridine-3-carboxylic acid methyl ester
Methyl 3-bromonicotinate
Methyl 5-bromonicotinate

 

Chemical Formula: C7H6BrNO2
Exact Mass: 214.96
Molecular Weight: 216.03
m/z: 214.96 (100.0%), 216.96 (98.0%), 215.96 (8.1%), 217.96 (7.5%)

 

InChI:InChI=1S/C7H6BrNO2/c1-11-7(10)5-2-6(8)4-9-3-5/h2-4H,1H3

InChI Key:AAJZXPWBILCHAW-UHFFFAOYSA-N

Canonical SMILES:COC(=O)C1=CC(=CN=C1)Br

Specification

98%
References

(1) Zon, Jerzy; CrystEngComm 2011, V13(10), P3474-3484 CAPLUS
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