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2D Structure
Also known as: 348-10-7, 2-(2-fluorophenoxy)acetic acid, (2-fluoro-phenoxy)-acetic acid, Acetic acid, (2-fluorophenoxy)-, Mfcd02223229, Enamine_002446
Molecular Formula
C8H7FO3
Molecular Weight
170.14  g/mol
InChI Key
CEAXCCNKYPOHDP-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-(2-fluorophenoxy)acetic acid
2.1.2 InChI
InChI=1S/C8H7FO3/c9-6-3-1-2-4-7(6)12-5-8(10)11/h1-4H,5H2,(H,10,11)
2.1.3 InChI Key
CEAXCCNKYPOHDP-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C(C(=C1)OCC(=O)O)F
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 348-10-7

2. 2-(2-fluorophenoxy)acetic Acid

3. (2-fluoro-phenoxy)-acetic Acid

4. Acetic Acid, (2-fluorophenoxy)-

5. Mfcd02223229

6. Enamine_002446

7. 2-(2-fluorophenoxy)acetic

8. Schembl257482

9. 2-(2-fluorophenoxy)aceticacid

10. (2-fluorophenyloxy)acetic Acid

11. (2-fluorophenoxy)acetic Acid #

12. Dtxsid80278826

13. [(2-fluorophenyl)oxy]acetic Acid

14. 2-(2-fluorophenoxy)-acetic Acid

15. Hms1400p04

16. Zinc262409

17. Albb-000256

18. Nsc10232

19. Bbl013906

20. Nsc-10232

21. Stk397466

22. (2-fluoro-phenoxy)-aceticacid

23. Akos000104348

24. (2-fluorophenoxy)acetic Acid, Aldrichcpr

25. As-10076

26. Sy008332

27. Db-069079

28. Bb 0217919

29. Cs-0072616

30. Ft-0678443

31. En300-00014

32. A874854

33. J-505621

34. F1791-0537

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 170.14 g/mol
Molecular Formula C8H7FO3
XLogP31.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass170.03792224 g/mol
Monoisotopic Mass170.03792224 g/mol
Topological Polar Surface Area46.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity160
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1