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Also known as: 150322-73-9, 1-cyclopropyl-2-(2-fluorophenyl)ethanone, Cyclopropyl2-fluorobenzylketone, 1-cyclopropyl-2-(2-fluoro-phenyl)-ethanone, 1-cyclopropyl-2-(2-fluorophenyl)ethan-1-one, Ethanone, 1-cyclopropyl-2-(2-fluorophenyl)-
Molecular Formula
C11H11FO
Molecular Weight
178.20  g/mol
InChI Key
DWBGTJUQWKWYGB-UHFFFAOYSA-N

CAS 150322-73-9
1 2D Structure

CAS 150322-73-9

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-cyclopropyl-2-(2-fluorophenyl)ethanone
2.1.2 InChI
InChI=1S/C11H11FO/c12-10-4-2-1-3-9(10)7-11(13)8-5-6-8/h1-4,8H,5-7H2
2.1.3 InChI Key
DWBGTJUQWKWYGB-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC1C(=O)CC2=CC=CC=C2F
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 150322-73-9

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

3. Cyclopropyl2-fluorobenzylketone

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

5. 1-cyclopropyl-2-(2-fluorophenyl)ethan-1-one

6. Ethanone, 1-cyclopropyl-2-(2-fluorophenyl)-

7. Mfcd10687164

8. 1-cyclopropyl-2-(2-fluorophenyl)-ethanone

9. Cyclopropyl-2-fluoro Benzyl Ketone

10. Prasugrl I

11. Schembl243780

12. O-fluorobenzyl Cyclopropyl Ketone

13. Dtxsid90571032

14. Act06895

15. Bcp00872

16. Zinc16697430

17. Akos005063958

18. Ac-5029

19. Ds-0463

20. Ps-6736

21. Sb33788

22. Sy019546

23. Db-029609

24. Am20030021

25. Cs-0037683

26. Ft-0649252

27. En300-80956

28. 1-cyclopropyl-2-(2-fluorophenyl)ethane-1-one

29. 322c739

30. A1-00017

31. Q-101053

2.3 Create Date
2007-02-09
3 Chemical and Physical Properties
Molecular Weight 178.20 g/mol
Molecular Formula C11H11FO
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass178.079393132 g/mol
Monoisotopic Mass178.079393132 g/mol
Topological Polar Surface Area17.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity198
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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