39856-50-3

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CHEMISTRY

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BUILDING BLOCK

2 Suppliers, 2 End Use APIs, 46 Related Intermediates

2 Suppliers
2 End Use APIs
46 Related Intermediates

Chemistry

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Also known as: 39856-50-3, 2-nitro-5-bromopyridine, 2-nitro-5-bromo pyridine, Pyridine, 5-bromo-2-nitro-, Mfcd00160411, Ec 609-748-8

Molecular Formula

C₅H₃BrN₂O₂

Molecular Weight

202.99 g/mol

InChI Key

ATXXLNCPVSUCNK-UHFFFAOYSA-N

1 2D Structure

39856-50-3

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

5-bromo-2-nitropyridine

2.1.2 InChI

InChI=1S/C5H3BrN2O2/c6-4-1-2-5(7-3-4)8(9)10/h1-3H

2.1.3 InChI Key

ATXXLNCPVSUCNK-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=NC=C1Br)[N+](=O)[O-]

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 39856-50-3

2. 2-nitro-5-bromopyridine

3. 2-nitro-5-bromo Pyridine

4. Pyridine, 5-bromo-2-nitro-

5. Mfcd00160411

6. Ec 609-748-8

7. 5-bromo-2-nitro-pyridine

8. 5-bromo2-nitropyridine

9. 5-bromo-2-nitropyridin

10. 3-bromo-6-nitro Pyridine

11. 5-bromo-2-nitro Pyridine

12. Schembl135841

13. Schembl2664539

14. 5-bromo-2-nitropyridine, 99%

15. Dtxsid20355827

16. Bcp21637

17. Cs-d1019

18. Str06165

19. Akos000267008

20. Ab04221

21. Ac-3148

22. Ps-5166

23. Bp-13029

24. Hy-59228

25. Sy004047

26. A6651

27. Am20051151

28. Ft-0602431

29. Ft-0620109

30. En300-80262

31. Ac-907/25014032

32. J-400310

33. Z361899954

2.3 Create Date

2005-07-08

3 Chemical and Physical Properties

Molecular Formula	C₅H₃BrN₂O₂
Molecular Weight	202.99 g/mol
XLogP3	1.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	58.7
Heavy Atom Count	10
Formal Charge	0
Complexity	136
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1