1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2,6-bis(chloromethyl)pyridine;hydrochloride

2.1.2 InChI

InChI=1S/C7H7Cl2N.ClH/c8-4-6-2-1-3-7(5-9)10-6;/h1-3H,4-5H2;1H

2.1.3 InChI Key

FGBGOYAWNBDXCH-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=NC(=C1)CCl)CCl.Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 55422-79-2

2. 2,6-dichloromethylpyridine Hydrochloride

3. 2,6-bis(chloromethyl)pyridine;hydrochloride

4. 2,6-bis(chloromethyl)pyridine, Hcl

5. 2,6-dichloromethyl Pyridine Hydrochloride

6. Pyridine, 2,6-bis(chloromethyl)-, Hydrochloride

7. 2,6-bis-(chloromethyl)pyridine Hydrochloride

8. Schembl6588203

9. Dtxsid20970771

10. Mfcd00185582

11. Nsc244971

12. Akos022190422

13. Nsc-244971

14. Bs-17054

15. Ft-0651668

16. D83093

17. 2,6-bis(chloromethyl)pyridinehydrochloride

18. A830636

19. 2,6-bis(chloromethyl)pyridine--hydrogen Chloride (1/1)

20. B0001-071475

2.3 Create Date

2007-02-07

3 Chemical and Physical Properties

Molecular Formula	C₇H₈Cl₃N
Molecular Weight	212.5 g/mol
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	210.972232 g/mol
Monoisotopic Mass	210.972232 g/mol
Topological Polar Surface Area	12.9 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	87.6
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	2

2,6-Bis(Chloromethyl)Pyridine Hydrochloride