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Also known as: 149806-06-4, 2-bromopyridine-5-carbaldehyde, 6-bromopyridine-3-carbaldehyde, 2-bromo-5-formylpyridine, 6-bromo-3-pyridinecarboxaldehyde, 2-bromopyridine-5-carboxaldehyde
Molecular Formula
C6H4BrNO
Molecular Weight
186.01  g/mol
InChI Key
PVUKGNBRJFTFNJ-UHFFFAOYSA-N
FDA UNII
Y2CE2F6NUU

149806-06-4
1 2D Structure

149806-06-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
6-bromopyridine-3-carbaldehyde
2.1.2 InChI
InChI=1S/C6H4BrNO/c7-6-2-1-5(4-9)3-8-6/h1-4H
2.1.3 InChI Key
PVUKGNBRJFTFNJ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=NC=C1C=O)Br
2.2 Other Identifiers
2.2.1 UNII
Y2CE2F6NUU
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 149806-06-4

2. 2-bromopyridine-5-carbaldehyde

3. 6-bromopyridine-3-carbaldehyde

4. 2-bromo-5-formylpyridine

5. 6-bromo-3-pyridinecarboxaldehyde

6. 2-bromopyridine-5-carboxaldehyde

7. 6-bromopyridine-3-carboxaldehyde

8. 3-pyridinecarboxaldehyde, 6-bromo-

9. 6-bromo-pyridine-3-carbaldehyde

10. 2-bromo-5-pyridinecarboxaldehyde

11. Mfcd04115419

12. 6-bromo-3-formylpyridine

13. 2-bromo-5-pyridinecarbaldehyde

14. 6-bromo-nicotinaldehyde

15. 3-formyl-6-bromopyridine

16. Y2ce2f6nuu

17. 2-bromo-5-formyl-pyridine

18. Schembl104184

19. 6-bromo-3-pyridinecarbaldehyde

20. Chembl4463248

21. Dtxsid70472119

22. 6-bromo-pyridine-3-carboxaldehyde

23. 2-bromo-pyridine-5-carboxaldehyde

24. 6-bromo-3-pyridine Carboxaldehyde

25. Bcp04709

26. Cs-d0958

27. Bbl103591

28. Stl557401

29. Akos005255345

30. Ac-2805

31. Pb27654

32. Ps-4860

33. 6-bromo-3-pyridinecarboxaldehyde, 95%

34. Hy-32786

35. Sy002969

36. Db-031415

37. Am20070058

38. B3491

39. En300-91110

40. W-201328

41. 6-bromopyridine-3-carboxaldehyde; 6-bromonicotinaldehyde

2.4 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 186.01 g/mol
Molecular Formula C6H4BrNO
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area30
Heavy Atom Count9
Formal Charge0
Complexity107
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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