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Also known as: 434-76-4, 6-fluoroanthranilic acid, Benzoic acid, 2-amino-6-fluoro-, Anthralic acid, 6-fluoro-, 2-azanyl-6-fluoranyl-benzoic acid, Mfcd00067781
Molecular Formula
C7H6FNO2
Molecular Weight
155.13  g/mol
InChI Key
RWSFZKWMVWPDGZ-UHFFFAOYSA-N

CAS 434-76-4
1 2D Structure

CAS 434-76-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-amino-6-fluorobenzoic acid
2.1.2 InChI
InChI=1S/C7H6FNO2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,9H2,(H,10,11)
2.1.3 InChI Key
RWSFZKWMVWPDGZ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=C(C(=C1)F)C(=O)O)N
2.2 Synonyms
2.2.1 MeSH Synonyms

1. 6-faba Cpd

2.2.2 Depositor-Supplied Synonyms

1. 434-76-4

2. 6-fluoroanthranilic Acid

3. Benzoic Acid, 2-amino-6-fluoro-

4. Anthralic Acid, 6-fluoro-

5. 2-azanyl-6-fluoranyl-benzoic Acid

6. Mfcd00067781

7. 2,amino-6-fluorobenzoic Acid

8. 2-amino-6-fluoro-benzoic Acid

9. 4owo

10. 6-fluoroanthranilate

11. 6-fluoroanthanilic Acid

12. Amino-6-fluorobenzoic Acid

13. 6-faba

14. 2-amino-6-fluorobenzoicacid

15. Oprea1_302702

16. Schembl283962

17. Chembl4453722

18. Dtxsid60963006

19. Pc1071m

20. Zinc153055

21. Act11906

22. Bcp16598

23. 2-amino-6-fluorobenzoic Acid, 98%

24. Akos005064108

25. Ac-3438

26. Bs-3856

27. Cs-w001131

28. Bp-20086

29. Sy005291

30. Db-024020

31. A1692

32. Am20061163

33. F0475

34. Ft-0621129

35. En300-41610

36. W-202763

37. Q27456372

38. Z1238477766

39. 6f0

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 155.13 g/mol
Molecular Formula C7H6FNO2
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass155.03825660 g/mol
Monoisotopic Mass155.03825660 g/mol
Topological Polar Surface Area63.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity163
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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