CAS 79055-62-2

1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-chloro-5-methylpyridin-4-amine

2.1.2 InChI

InChI=1S/C6H7ClN2/c1-4-3-9-6(7)2-5(4)8/h2-3H,1H3,(H2,8,9)

2.1.3 InChI Key

CJGKOPNIXJWHKF-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=CN=C(C=C1N)Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 79055-62-2

2. 2-chloro-5-methyl-pyridin-4-ylamine

3. 4-amino-2-chloro-5-methylpyridine

4. 4-pyridinamine, 2-chloro-5-methyl-

5. 2-chloro-5-methyl-4-pyridinamine

6. Mfcd11977435

7. 4-pyridinamine,2-chloro-5-methyl-

8. 4-amino-5-methyl-2-chloropyridine

9. Schembl2596935

10. Dtxsid70505451

11. Cjgkopnixjwhkf-uhfffaoysa-n

12. Akos006361159

13. Ab65156

14. Am85914

15. Cs-w021662

16. Ac-25001

17. Sy035222

18. Ts-01857

19. En300-102234

20. A839562

21. A1-11378

22. J-515983

23. 2-chloro-5-methyl-pyridin-4-amine;4-amino-2-chloro-5-methylpyridine

2.3 Create Date

2007-02-08

3 Chemical and Physical Properties

Molecular Formula	C₆H₇ClN₂
Molecular Weight	142.58 g/mol
XLogP3	1.5
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	9
Formal Charge	0
Complexity	97.1
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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