Please Wait
Applying Filters...
Menu
$ API Ref.Price (USD/KG) : 893Xls
2D Structure
Also known as: 4619-74-3, Micatex, 2,4,6-tribromo-m-cresol, Triphysan, Triphysol, Tribromometacresol
Molecular Formula
C7H5Br3O
Molecular Weight
344.83  g/mol
InChI Key
QKHROXOPRBWBDD-UHFFFAOYSA-N
FDA UNII
Q3Z845166M

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2,4,6-tribromo-3-methylphenol
2.1.2 InChI
InChI=1S/C7H5Br3O/c1-3-4(8)2-5(9)7(11)6(3)10/h2,11H,1H3
2.1.3 InChI Key
QKHROXOPRBWBDD-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=C(C(=C(C=C1Br)Br)O)Br
2.2 Other Identifiers
2.2.1 UNII
Q3Z845166M
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 4619-74-3

2. Micatex

3. 2,4,6-tribromo-m-cresol

4. Triphysan

5. Triphysol

6. Tribromometacresol

7. 3-methyl-2,4,6-tribromophenol

8. M-cresol, 2,4,6-tribromo-

9. Phenol, 2,4,6-tribromo-3-methyl-

10. Nsc-74686

11. Q3z845166m

12. Einecs 225-032-4

13. Nsc 74686

14. Brn 1949974

15. Unii-q3z845166m

16. 2,4,6-tribromo-m-cresol (oh=1)

17. 2,6-tribromo-m-cresol

18. M-cresol,4,6-tribromo-

19. 3-06-00-01324 (beilstein Handbook Reference)

20. 2,6-tribromo-3-methylphenol

21. Schembl467297

22. Wln: Qr Be De Fe C1

23. Chembl3707340

24. Phenol,4,6-tribromo-3-methyl-

25. Dtxsid40196754

26. Chebi:135457

27. Zinc404196

28. 2,4,6-tribromo-m-cresol(oh=1)

29. Nsc74686

30. Mfcd00019976

31. Akos015890412

32. Db13513

33. Hy-w319335

34. (anilinocarbonyl)amino]aceticacid

35. 2,4,6-tribromo-m-cresol [mi]

36. Ac-23681

37. Db-013956

38. 2,4,6-tribromo-m-cresol [who-dd]

39. Cs-0358959

40. Ft-0609839

41. F20934

42. A827005

43. Q7840447

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 344.83 g/mol
Molecular Formula C7H5Br3O
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass343.78700 g/mol
Monoisotopic Mass341.78905 g/mol
Topological Polar Surface Area20.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity142
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 ATC Code

D - Dermatologicals

D01 - Antifungals for dermatological use

D01A - Antifungals for topical use

D01AE - Other antifungals for topical use

D01AE03 - Tribromometacresol