45644-21-1

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Also known as: 45644-21-1, 6-chloropyridin-2-amine, 6-chloro-2-pyridinamine, 2-pyridinamine, 6-chloro-, 2-chloro-6-aminopyridine, Pyridine, 2-amino-6-chloro-

Molecular Formula

C₅H₅ClN₂

Molecular Weight

128.56 g/mol

InChI Key

OBYJTLDIQBWBHM-UHFFFAOYSA-N

1 2D Structure

CAS 45644-21-1

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

6-chloropyridin-2-amine

2.1.2 InChI

InChI=1S/C5H5ClN2/c6-4-2-1-3-5(7)8-4/h1-3H,(H2,7,8)

2.1.3 InChI Key

OBYJTLDIQBWBHM-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=NC(=C1)Cl)N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 45644-21-1

2. 6-chloropyridin-2-amine

3. 6-chloro-2-pyridinamine

4. 2-pyridinamine, 6-chloro-

5. 2-chloro-6-aminopyridine

6. Pyridine, 2-amino-6-chloro-

7. 6-chloropyridin-2-ylamine

8. Mfcd00234068

9. 6-chloro-pyridin-2-ylamine

10. Brn 0108669

11. 6-chloro-2-aminopyridine

12. 6-amino-2-chloropyridine

13. 6-chloro-2-pyridinylamine

14. 2-chloro-6-amino-pyridine

15. 4-22-00-04028 (beilstein Handbook Reference)

16. Schembl117748

17. 2-amino-6-chloropyridine (6-chloropyridin-2-ylamine)

18. Dtxsid20196575

19. 2-amino-6-chloropyridine, 97%

20. Bcp22216

21. Cl0045

22. Akos000275942

23. Ac-1411

24. Cs-w002551

25. Pb26011

26. Ps-5492

27. Sy003744

28. Db-010165

29. A7183

30. Am20070061

31. En300-86280

32. Ac-907/25004401

33. W-202806

2.3 Create Date

2005-07-08

3 Chemical and Physical Properties

Molecular Formula	C₅H₅ClN₂
Molecular Weight	128.56 g/mol
XLogP3	0.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	38.9
Heavy Atom Count	8
Formal Charge	0
Complexity	76.8
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

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