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Also known as: 18523-22-3, 2,3'-dibromoacetophenone, 2-bromo-1-(3-bromophenyl)ethanone, Ethanone, 2-bromo-1-(3-bromophenyl)-, 2-bromo-3'-bromoacetophenone, 3-bromophenacylbromide
Molecular Formula
C8H6Br2O
Molecular Weight
277.94  g/mol
InChI Key
MZBXSQBQPJWECM-UHFFFAOYSA-N

CAS 18523-22-3
1 2D Structure

CAS 18523-22-3

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-bromo-1-(3-bromophenyl)ethanone
2.1.2 InChI
InChI=1S/C8H6Br2O/c9-5-8(11)6-2-1-3-7(10)4-6/h1-4H,5H2
2.1.3 InChI Key
MZBXSQBQPJWECM-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC(=C1)Br)C(=O)CBr
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 18523-22-3

2. 2,3'-dibromoacetophenone

3. 2-bromo-1-(3-bromophenyl)ethanone

4. Ethanone, 2-bromo-1-(3-bromophenyl)-

5. 2-bromo-3'-bromoacetophenone

6. 3-bromophenacylbromide

7. Mfcd00082698

8. 2-bromo-1-(3-bromo-phenyl)-ethanone

9. 2-bromo-1-(3-bromophenyl)ethan-1-one

10. A,3'-dibromoacetophenone

11. 2-bromo-1-(3-bromophenyl)-1-ethanone

12. M-bromophenacyl Bromide

13. 2,3-dibromoacetophenone

14. 3'-bromophenacyl Bromide

15. 3',alpha-dibromoacetophenone

16. Schembl316026

17. 2-bromo-3'-bromo Acetophenone

18. Dtxsid80334077

19. 2,3'-dibromoacetophenone, 97%

20. Zinc153534

21. Ck2554

22. Stl301840

23. Akos000210259

24. 2-bromo-1-(3-bromophenyl)ethanone #

25. Cs-w012301

26. Ps-10009

27. Sy014721

28. Db-044552

29. Ft-0615235

30. Ft-0615236

31. 2,3 Inverted Exclamation Mark -dibromoacetophenone

32. A812935

33. J-011877

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 277.94 g/mol
Molecular Formula C8H6Br2O
XLogP33.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass277.87649 g/mol
Monoisotopic Mass275.87854 g/mol
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity147
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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