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Also known as: 127337-60-4, 2-chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine hydrochloride, 2-chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine, hydrochloride, 2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine;hydrochloride, 2-chloromethyl-3-methyl-4-(2,2,2-trifluoro-ethoxy)-pyridine hydrochloride, 75qfd5bt69
Molecular Formula
C9H10Cl2F3NO
Molecular Weight
276.08  g/mol
InChI Key
CMZBQUWICURDCD-UHFFFAOYSA-N
FDA UNII
75QFD5BT69

CAS 127337-60-4
1 2D Structure

CAS 127337-60-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine;hydrochloride
2.1.2 InChI
InChI=1S/C9H9ClF3NO.ClH/c1-6-7(4-10)14-3-2-8(6)15-5-9(11,12)13;/h2-3H,4-5H2,1H3;1H
2.1.3 InChI Key
CMZBQUWICURDCD-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=C(C=CN=C1CCl)OCC(F)(F)F.Cl
2.2 Other Identifiers
2.2.1 UNII
75QFD5BT69
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 127337-60-4

2. 2-chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine Hydrochloride

3. 2-chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine, Hydrochloride

4. 2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine;hydrochloride

5. 2-chloromethyl-3-methyl-4-(2,2,2-trifluoro-ethoxy)-pyridine Hydrochloride

6. 75qfd5bt69

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

8. Mfcd00800224

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

10. 2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine Hcl

11. 2-chloromethyl-3-methyl-4-(2,2,2-trifluoro-ethoxy)pyridine Hydrochloride

12. 2-chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)-pyridine Hydrochloride

13. Pyridine, 2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)-, Hydrochloride (1:1)

14. Milbemycinb,12-demethyl-5-o-demethyl-28-deoxy-25-(1,3-dimethyl-1-butenyl)-6,28-epoxy-12,23-dihydroxy-,[6r,23s,25s(e)]-(9ci)

15. Lansoprazole Intermediates

16. Ec 603-200-1

17. 2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine Hydrochloride (1:1)

18. Unii-75qfd5bt69

19. Amy438

20. Schembl1681187

21. Dtxsid40584470

22. 2-chloromethyl-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine Hcl

23. Bcp12353

24. Akos015845926

25. Cs-w002690

26. Sb32604

27. Ac-15532

28. As-11876

29. Sy014456

30. Db-020939

31. Ft-0643064

32. 337c604

33. A805683

34. J-509029

35. 2-chloromethyl-3-methyl-4-(2,2,2-trifluoro-ethoxy) -pyridine Hydrochloride

36. 3-methyl-4-(2,2,2,-trifluoroethoxy)-2-chloromethylpyridine Hydrochloride

37. 3-methyl-4-(2,2,2-trifluoroethoxy)-2-chloromethylpyridine Hydrochloride

38. 2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine Hydrochloride, 97%

39. 2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine--hydrogen Chloride (1/1)

40. 2-(chloromethyl)-4-(2,2,2-trifluoroethoxy)pyridine Hydrochloride;2-chloromethyl-3-methyl-4-(2,2,2-trifluoro-ethoxy)-pyridine Hcl

2.4 Create Date
2007-07-16
3 Chemical and Physical Properties
Molecular Weight 276.08 g/mol
Molecular Formula C9H10Cl2F3NO
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass275.0091538 g/mol
Monoisotopic Mass275.0091538 g/mol
Topological Polar Surface Area22.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity200
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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