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Also known as: 153259-31-5, 2-chloromethyl-3-methyl-4-(3-methoxypropoxy)pyridine hydrochloride, 2-chloromethyl-4-methoxypropoxy-3-methylpyridine hydrochloride, 2-chloromethyl-4-(3-methoxypropoxy)-3-methylpyridine hydrochloride, 2-(chloromethyl)-4-(3-methoxypropoxy)-3-methylpyridine;hydrochloride, Mfcd06658231
Molecular Formula
C11H17Cl2NO2
Molecular Weight
266.16  g/mol
InChI Key
MNVYUQSFAJMSCS-UHFFFAOYSA-N

CAS 153259-31-5
1 2D Structure

CAS 153259-31-5

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-(chloromethyl)-4-(3-methoxypropoxy)-3-methylpyridine;hydrochloride
2.1.2 InChI
InChI=1S/C11H16ClNO2.ClH/c1-9-10(8-12)13-5-4-11(9)15-7-3-6-14-2;/h4-5H,3,6-8H2,1-2H3;1H
2.1.3 InChI Key
MNVYUQSFAJMSCS-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=C(C=CN=C1CCl)OCCCOC.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 153259-31-5

2. 2-chloromethyl-3-methyl-4-(3-methoxypropoxy)pyridine Hydrochloride

3. 2-chloromethyl-4-methoxypropoxy-3-methylpyridine Hydrochloride

4. 2-chloromethyl-4-(3-methoxypropoxy)-3-methylpyridine Hydrochloride

5. 2-(chloromethyl)-4-(3-methoxypropoxy)-3-methylpyridine;hydrochloride

6. Mfcd06658231

7. 2-chloromethyl-3-methyl-4-(3-methoxypropoxy)pyridine, Hcl

8. 4-(3-methoxypropoxy)-2-(chloromethyl)-3-methylpyridine Hydrochlorid

9. 2-chloromethyl-3-methyl-4-(3-methoxypropoxy)pyridine Hcl

10. Schembl2781673

11. Dtxsid50596322

12. Act01508

13. Bcp12263

14. 2-chloromethyl-3-methyl-4-(3-methoxy Propoxy)pyridine Hydrochloride

15. 2-chloromethyl-3-methyl-4-(3-methoxypropanoxy)pyridine Hydrochloride

16. Akos015891520

17. Ac-4558

18. Ac-8345

19. Am84488

20. Cs-w021431

21. Ds-1446

22. Bl009616

23. Sy023611

24. Db-020941

25. Ft-0643501

26. 259c315

27. J-008994

28. Q-200145

29. 2-(chloromethyl)-4-(3-methoxypropoxy)-3-methylpyridine Hcl

30. 2-chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy) Pyridine Hcl

31. 2-(chloromethyl)-4-(3-methoxypropoxy)-3-methylpyridine Hydrochloride (1:1)

32. 2-chloromethyl-3-methyl-4-(3-meyhoxylpropanoxyl)pyridine Hydrochloride

33. 2-(chloromethyl)-4-(3-methoxypropoxy)-3-methylpyridine--hydrogen Chloride (1/1)

34. 2-chloromethyl-4-(3-methoxy-propoxy)-3-methyl-pyridine; Hydrochloride;2-chloromethyl-3-methyl-4-(3-methoxypropoxy)pyridine Hcl

2.3 Create Date
2007-12-04
3 Chemical and Physical Properties
Molecular Weight 266.16 g/mol
Molecular Formula C11H17Cl2NO2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass265.0636342 g/mol
Monoisotopic Mass265.0636342 g/mol
Topological Polar Surface Area31.4 Ų
Heavy Atom Count16
Formal Charge0
Complexity169
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

BUILDING BLOCK

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