CAS 24596-19-8

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Also known as: 24596-19-8, 4-bromo-2,6-xylidine, Benzenamine, 4-bromo-2,6-dimethyl-, 4-bromo-2,6-dimethyl-phenylamine, 2,6-dimethyl-4-bromoaniline, 4-bromo-2,6-dimethylbenzenamine

Molecular Formula

C₈H₁₀BrN

Molecular Weight

200.08 g/mol

InChI Key

QGLAYJCJLHNIGJ-UHFFFAOYSA-N

FDA UNII

9W5K8J5F6B

1 2D Structure

CAS 24596-19-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-bromo-2,6-dimethylaniline

2.1.2 InChI

InChI=1S/C8H10BrN/c1-5-3-7(9)4-6(2)8(5)10/h3-4H,10H2,1-2H3

2.1.3 InChI Key

QGLAYJCJLHNIGJ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=CC(=CC(=C1N)C)Br

2.2 Other Identifiers

2.2.1 UNII

9W5K8J5F6B

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 24596-19-8

2. 4-bromo-2,6-xylidine

3. Benzenamine, 4-bromo-2,6-dimethyl-

4. 4-bromo-2,6-dimethyl-phenylamine

5. 2,6-dimethyl-4-bromoaniline

6. 4-bromo-2,6-dimethylbenzenamine

7. 4-bromo-2,6-dimethylphenylamine

8. 9w5k8j5f6b

9. Nsc-227944

10. En300-31727

11. 4-bromo-2,6-dimethyl-aniline

12. (4-bromo-2,6-dimethylphenyl)amine

13. Einecs 246-337-9

14. Nsc227944

15. 2,6-xylidine, 4-bromo-

16. 4-bromo-2,6dimethylaniline

17. Unii-9w5k8j5f6b

18. Schembl146892

19. 4-bromo-2,6-di-methylaniline

20. Dtxsid40179345

21. 4-bromo-2,6-dimethyl Phenylamine

22. Aniline, 4-bromo-2,6-dimethyl-

23. Bdbm626140

24. Albb-025703

25. Cl4142

26. Mfcd00007826

27. Stk345441

28. 4-bromo-2,6-dimethylaniline, 98%

29. Akos000111247

30. Ac-3649

31. Cs-w019870

32. Nsc 227944

33. Ps-6202

34. Sb77433

35. 4-bromo-2,6-dimethylphenylamine (4-bromo-2,6-dimethylaniline; 4-bromo-2,6-xylidine)

36. Db-023849

37. Am20030446

38. B1909

39. Ns00027700

40. A930322

41. An-652/40879414

42. W-107297

43. Q63398931

44. Z335243396

45. Inchi=1/c8h10brn/c1-5-3-7(9)4-6(2)8(5)10/h3-4h,10h2,1-2h

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₈H₁₀BrN
Molecular Weight	200.08 g/mol
XLogP3	2.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	26
Heavy Atom Count	10
Formal Charge	0
Complexity	104
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