CAS 204205-33-4

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16 Related Intermediates

Chemistry

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Also known as: 204205-33-4, 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethanone, Ethanone, 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-, 2-bromo-1-cyclopropyl-2-(2-fluoro-phenyl)-ethanone, Mfcd11977644, 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethan-1-one

Molecular Formula

C₁₁H₁₀BrFO

Molecular Weight

257.10 g/mol

InChI Key

LMCZCCDXOZGIND-UHFFFAOYSA-N

1 2D Structure

CAS 204205-33-4

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethanone

2.1.2 InChI

InChI=1S/C11H10BrFO/c12-10(11(14)7-5-6-7)8-3-1-2-4-9(8)13/h1-4,7,10H,5-6H2

2.1.3 InChI Key

LMCZCCDXOZGIND-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CC1C(=O)C(C2=CC=CC=C2F)Br

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 204205-33-4

2. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethanone

3. Ethanone, 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-

4. 2-bromo-1-cyclopropyl-2-(2-fluoro-phenyl)-ethanone

5. Mfcd11977644

6. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)ethan-1-one

7. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-ethanone

8. Schembl242256

9. Dtxsid60634062

10. Bcp11003

11. Akos015854297

12. Sb35193

13. Ac-22646

14. As-11428

15. Cyclopropyl Carbonyl-2-fluorobenzylbromide

16. Sy067317

17. Db-027830

18. Am20090723

19. B6031

20. Ft-0649302

21. Alpha-cyclopropylcarbonyl-2-fluorobenzylbromide

22. Alpha-cyclopropylcarbonyl-2-fluorobenzyl Bromide

23. 2-bromo-2-(2-fluorophenyl)-1-cyclopropylethanon

24. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-etanon

25. 2-bromo-1-cyclopropyl-2-(2-fluorphenyl)-ethanon

26. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl) Ethanone

27. 2-bromo-2-(2-fluorophenyl)-1-cyclopropyl-ethanone

28. J-508185

29. 2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-?ethanone

30. Ethanone,2-bromo-1-cyclopropyl-2-(2-fluorophenyl)-

2.3 Create Date

2007-12-06

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₀BrFO
Molecular Weight	257.10 g/mol
XLogP3	3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	255.98991 g/mol
Monoisotopic Mass	255.98991 g/mol
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	227
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1