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CAS Number: 31181-90-5
5-bromopicolinaldehyde

Structure

5-bromopicolinaldehyde
Name: 5-bromopicolinaldehyde
Synonyms:
General Information
Product Number: 31181905
CAS Registry Number:
31181-90-5
Name:
2-Pyridinecarboxaldehyde, 5-bromo-
Picolinaldehyde, 5-bromo- (8CI); 5-Bromo-2-formylpyridine; 5-Bromo-2-picolinaldehyde; 5-Bromo-2-pyridinaldehyde; 5-Bromo-2-pyridinecarbaldehyde; 5-Bromo-2-pyridinecarboxaldehyde 
 
Chemical Formula: C6H4BrNO
Exact Mass: 184.95
Molecular Weight: 186.01
m/z: 184.95 (100.0%), 186.95 (97.7%), 185.95 (6.6%), 187.95 (6.4%)
Elemental Analysis: C, 38.74; H, 2.17; Br, 42.96; N, 7.53; O, 8.60
 
MDL: MFCD04112535. 
InChI: InChI=1S/C6H4BrNO/c7-5-1-2-6(4-9)8-3-5/h1-4H
InChIKey: ZQVLPMNLLKGGIU-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=NC=C1Br)C=O
 
Thermal Properties Value Condition Note
Melting Point 96-98 °C   (1)CAS
Melting Point See full text   (2)CAS

Specification

98%

References
  1. (1) Rajadurai, Chandrasekar; Journal of Organic Chemistry 2003, V68(26), P9907-9915 CAPLUS
  2. (2) Mandal, Ashis Baran; Tetrahedron Letters 2005, V46(36), P6033-6036 CAPLUS
  3. (3) Comba, Peter; Chemistry - A European Journal 2008, V14(17), P5313-5328 CAPLUS
  4. (4) Song, Jinhua J.; Organic Letters 2004, V6(26), P4905-4907 CAPLUS
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