Guangdong Raffles Pharmatech Co Ltd

CAS 20443-98-5

Chemistry, 1 End Use API, 9 Related Intermediates

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Also known as: 20443-98-5, 2-(bromomethyl)-1,3-dichlorobenzene, Alpha-bromo-2,6-dichlorotoluene, Benzene, 2-(bromomethyl)-1,3-dichloro-, 2,6-dichlorobenzylbromide, 1-bromomethyl-2,6-dichlorobenzene

Molecular Formula

C₇H₅BrCl₂

Molecular Weight

239.92 g/mol

InChI Key

PDFGFQUSSYSWNI-UHFFFAOYSA-N

FDA UNII

MP9K6Y018H

1 2D Structure

CAS 20443-98-5

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(bromomethyl)-1,3-dichlorobenzene

2.1.2 InChI

InChI=1S/C7H5BrCl2/c8-4-5-6(9)2-1-3-7(5)10/h1-3H,4H2

2.1.3 InChI Key

PDFGFQUSSYSWNI-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=C(C(=C1)Cl)CBr)Cl

2.2 Other Identifiers

2.2.1 UNII

MP9K6Y018H

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 20443-98-5

2. 2-(bromomethyl)-1,3-dichlorobenzene

3. Alpha-bromo-2,6-dichlorotoluene

4. Benzene, 2-(bromomethyl)-1,3-dichloro-

5. 2,6-dichlorobenzylbromide

6. 1-bromomethyl-2,6-dichlorobenzene

7. .alpha.-bromo-2,6-dichlorotoluene

8. A-bromo-2,6-dichlorotoluene

9. Mp9k6y018h

10. Nsc-93898

11. Einecs 243-827-4

12. Nsc 93898

13. Brn 0637351

14. 2,6 Dichloro Benzyl Bromide

15. Benzene, 2-(bromomethyl)-1,3-dichloro- (9ci)

16. Mfcd00000577

17. Toluene, Alpha-bromo-2,6-dichloro-

18. Schembl9770

19. Unii-mp9k6y018h

20. 2, 6-dichlorobenzyl Bromide

21. 4-05-00-00834 (beilstein Handbook Reference)

22. 2,6-di Chloro Benzyl Bromide

23. Dtxsid60174392

24. 2,6-dichlorobenzyl Bromide, 97%

25. 2-bromomethyl-1,3-dichlorobenzene

26. Act00502

27. Nsc93898

28. Str03144

29. Zinc1609561

30. Stl280128

31. 2-(brornomethyl)-1,3-dichlorobenzene

32. Akos007929978

33. 2-(bromomethyl)-1,3-dichloro-benzene

34. Am84244

35. Toluene, .alpha.-bromo-2,6-dichloro-

36. 2-(bromomethyl)-1,3-dichlorobenzene #

37. Ac-26185

38. D1749

39. Ft-0610602

40. A22382

41. W-107620

42. F0001-0724

43. (6-bromo-imidazo[1,2-a]pyridin-2-yl)-aceticacid

44. Alpha-bromo-2,6-dichloro-toluen;2-(bromomethyl)-1,3-dichlorobenzene

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₇H₅BrCl₂
Molecular Weight	239.92 g/mol
XLogP3	3.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	237.89517 g/mol
Monoisotopic Mass	237.89517 g/mol
Topological Polar Surface Area	0 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	97.8
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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CAS Number

452339-73-0

End Use API

Vilanterol Trifenatate

About the Company

Established in August 2011, Raffles PharmaTech is a high-tech enterprise that focus on development, manuf...

Established in August 2011, Raffles PharmaTech is a high-tech enterprise that focus on development, manufacturing and sales of high-value added active pharmaceutical ingredients and intermediates. We are specialized in applying organic catalysts into the process development to lower cost, and to provide cost-effective product and service to customers. With our strong R&D capability and our proprietary organic catalysts, we provide low cost and high quality active pharmaceutical ingredients and intermediates to pharmaceutical companies. We also provide world standard process development, custom synthesis and manufacturing service.

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