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CAS Number: 21190-88-5
ethyl 6-bromopicolinate

Structure

ethyl 6-bromopicolinate
Name: ethyl 6-bromopicolinate
Synonyms:
General Information
Product Number: 21190885
CAS Registry Number: 21190-88-5
Name:
        2-​Pyridinecarboxylic acid, 6-​bromo-​, ethyl ester
        Picolinic acid, 6-​bromo-​, ethyl ester (8CI); 2-​Bromo-​6-​ethoxycarbonylpyridi​ne; 6-​Bromo-​2-​pyridinecarboxylic acid ethyl ester; 6-​Bromopicolinic acid ethyl ester; Ethyl 6-​bromo-​2-​picolinate; Ethyl 6-​bromo-​2-​pyridinecarboxylate 
 
Chemical Formula: C8H8BrNO2
Exact Mass: 228.97
Molecular Weight: 230.06
m/z: 228.97 (100.0%), 230.97 (97.3%), 229.98 (8.8%), 231.98 (8.6%)
Elemental Analysis: C, 41.77; H, 3.50; Br, 34.73; N, 6.09; O, 13.91
 
InChI: InChI=1S/C8H8BrNO2/c1-2-12-8(11)6-4-3-5-7(9)10-6/h3-5H,2H2,1H3
InChIKey: OONBOXSIWCBAHZ-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=NC(=CC=C1)Br
 
Thermal Properties Value Condition Note
Melting Point 40-41 °C   (2)CAS
Melting Point 37-38 °C   (3)CAS

Specification

98%

References
  1. (1) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  2. (2) El-ghayoury, Abdelkrim; Journal of Organic Chemistry 2000, V65(23), P7757-7763 CAPLUS
  3. (3) Buchmann, Gerhard; Pharmazie 1968, V23(10), P557-60 CAPLUS
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