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2D Structure
Also known as: 3988-03-2, Bis(4-bromophenyl)methanone, Methanone, bis(4-bromophenyl)-, P,p'-dibromobenzophenone, 4,4-dibromobenzophenone, Bis(p-bromophenyl) ketone
Molecular Formula
C13H8Br2O
Molecular Weight
340.01  g/mol
InChI Key
LFABNOYDEODDFX-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
bis(4-bromophenyl)methanone
2.1.2 InChI
InChI=1S/C13H8Br2O/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8H
2.1.3 InChI Key
LFABNOYDEODDFX-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Br)Br
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 3988-03-2

2. Bis(4-bromophenyl)methanone

3. Methanone, Bis(4-bromophenyl)-

4. P,p'-dibromobenzophenone

5. 4,4-dibromobenzophenone

6. Bis(p-bromophenyl) Ketone

7. Mfcd00016330

8. Benzophenone, 4,4'-dibromo-

9. Methanone, Bis[4-bromophenyl]-

10. Nsc86518

11. 4,4'-dibromobenzophenon

12. Benzophenone,4'-dibromo-

13. Bis(4-bromophenyl) Ketone

14. 4,4\'-dibromobenzophenone

15. Bis-(4-bromophenyl)methanone

16. 4,4 Inverted Exclamation Marka-dibromobenzophenone

17. Chembl75538

18. Schembl132367

19. Dtxsid00192919

20. 4,4'-dibromobenzophenone, 97%

21. Zinc155194

22. Act08021

23. Einecs 223-632-0

24. Ac-317

25. Bbl103287

26. Nsc 86518

27. Nsc-86518

28. Stl557097

29. Akos009159017

30. Cs-w004608

31. As-15648

32. Sy038970

33. Db-049492

34. D5211

35. Ft-0635095

36. Ft-0696463

37. 4,4 Inverted Exclamation Mark -dibromobenzophenone

38. 988d032

39. 4,4'-dibromobenzophenone, Purum, >=98.0% (gc)

40. F0001-1120

41. 4,4'-dibromobenzophenone, Pestanal(r), Analytical Standard

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 340.01 g/mol
Molecular Formula C13H8Br2O
XLogP35
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass339.89214 g/mol
Monoisotopic Mass337.89419 g/mol
Topological Polar Surface Area17.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity214
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1