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CAS 4072-67-7
Also known as: 4072-67-7, 1,1'-([1,1'-biphenyl]-4,4'-diyl)bis(2-bromoethanone), 2-bromo-1-[4-[4-(2-bromoacetyl)phenyl]phenyl]ethanone, 4,4'-bis(bromoacetyl)biphenyl, Ethanone, 1,1'-[1,1'-biphenyl]-4,4'-diylbis[2-bromo-, 1,1'-(1,1'-biphenyl)-4,4'-diylbis(2-bromoethan-1-one
Molecular Formula
C16H12Br2O2
Molecular Weight
396.07  g/mol
InChI Key
RTSLQVZQORGDQQ-UHFFFAOYSA-N

1 2D Structure

CAS 4072-67-7

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-bromo-1-[4-[4-(2-bromoacetyl)phenyl]phenyl]ethanone
2.1.2 InChI
InChI=1S/C16H12Br2O2/c17-9-15(19)13-5-1-11(2-6-13)12-3-7-14(8-4-12)16(20)10-18/h1-8H,9-10H2
2.1.3 InChI Key
RTSLQVZQORGDQQ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)CBr)C(=O)CBr
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 4072-67-7

2. 1,1'-([1,1'-biphenyl]-4,4'-diyl)bis(2-bromoethanone)

3. 2-bromo-1-[4-[4-(2-bromoacetyl)phenyl]phenyl]ethanone

4. 4,4'-bis(bromoacetyl)biphenyl

5. Ethanone, 1,1'-[1,1'-biphenyl]-4,4'-diylbis[2-bromo-

6. 1,1'-(1,1'-biphenyl)-4,4'-diylbis(2-bromoethan-1-one

7. Ethanone, 1,1'-(1,1'-biphenyl)-4,4'-diylbis(2-bromo-

8. 2-bromo-1-[4-[4-(2-bromoacetyl)phenyl]phenyl]ethanone;1,1'-([1,1'-biphenyl]-4,4'-diyl)bis(2-bromoethanone);2-bromo-1-[4-[4-(2-bromoacetyl)phenyl]phenyl]ethanone

9. Einecs 223-785-3

10. Mfcd00017877

11. Nsc619613

12. 1,1'-([1,1'-biphenyl]-4,4'-diyl)bis(2-bromoethan-1-one)

13. 4,4'-bis-bromoacetylbiphenyl

14. Schembl689331

15. Dtxsid0063286

16. Amy8890

17. Bcp11440

18. Zinc1614316

19. 4,4''-bis(2-bromoacetyl)biphenyl

20. Akos015994936

21. Nsc-619613

22. S11035

23. Ac-28960

24. As-60505

25. 4,4'-bis (2-bromoacetyl) Biphenyl

26. A26175

27. 072b677

28. 1,1'-(1,1'-biphenyl)-4,4'-diylbis(2-bromoethan-1-one)

29. 2-bromo-1-[4'-(2-bromoacetyl)-[1,1'-biphenyl]-4-yl]ethan-1-one

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 396.07 g/mol
Molecular Formula C16H12Br2O2
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass395.91836 g/mol
Monoisotopic Mass393.92040 g/mol
Topological Polar Surface Area34.1 Ų
Heavy Atom Count20
Formal Charge0
Complexity306
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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Jiangsu Yutian Pharmaceutical Co., Ltd. is located in Dapu Pharmaceutical Zone of Lianyungang City in Jia...
Jiangsu Yutian Pharmaceutical Co., Ltd. is located in Dapu Pharmaceutical Zone of Lianyungang City in Jiangsu Province. It is a new and high-tech enterprise engaged in research and production of bulk pharmaceutical chemicals, medical high-grade intermediate and other fine chemicals. We make efforts to provide wide customers with superior quality product. Covering an area of 66400 square meters and a construction area of 37600 square meters, our company has 8 synthesis plants, 1 GMP and FDA standard cleaning shop, modern and advanced production equipment, leading grade laboratory and excellent quality control center. In addition, there is outstanding technology development, production and management talents. Due to high quality and superior service, our products have been exported to Japan, South Korea, India and Europe. We sincerely welcome wide customers to visit us and pay guidance on our work! We would like to create brilliant future hand in hand with you!
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OctaneX Labs is a leading intermediates and Active Pharmaceutical Ingredients (API) manufacturing company...
OctaneX Labs is a leading intermediates and Active Pharmaceutical Ingredients (API) manufacturing company specializing in the development of innovative processes for the synthesis of a wide range of products. We also undertake custom pharmaceutical services and contract Research Synthesis. We are commited to create better quality of life by being at the forefront of research, manufacturing and marketing of high quality API'S.As a growing organization, we are aware that we can’t achieve our goals singly. We collaborate and work in unison with a large number of reputed and like-minded partners
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Prajna is an innovation driven pharmaceutical company. We dedicated to Research, Process development and ...
Prajna is an innovation driven pharmaceutical company. We dedicated to Research, Process development and Manufacturing APIs and Advanced Intermediates for Active Pharmaceutical Ingredients (APIs) for the global pharmaceutical companies. It provides value-added services in Contract Research, Custom Synthesis, and Specialties Scientific technology (Green Process, APIs Process Development, Polymorphism, Crystallisation and Purification) for Pharmaceutical and Life Sciences industry.
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