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2D Structure
Also known as: 617-597-4, Fendizoic acid, 84627-04-3, 2-(6-hydroxy-[1,1'-biphenyl]-3-carbonyl)benzoic acid, Fendizoate, 2-(6-hydroxy-biphenyl-3-carbonyl)-benzoic acid
Molecular Formula
C20H14O4
Molecular Weight
318.3  g/mol
InChI Key
PKHPZNKXOBWFCX-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-(4-hydroxy-3-phenylbenzoyl)benzoic acid
2.1.2 InChI
InChI=1S/C20H14O4/c21-18-11-10-14(12-17(18)13-6-2-1-3-7-13)19(22)15-8-4-5-9-16(15)20(23)24/h1-12,21H,(H,23,24)
2.1.3 InChI Key
PKHPZNKXOBWFCX-UHFFFAOYSA-N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 617-597-4

2. Fendizoic Acid

3. 84627-04-3

4. 2-(6-hydroxy-[1,1'-biphenyl]-3-carbonyl)benzoic Acid

5. Fendizoate

6. 2-(6-hydroxy-biphenyl-3-carbonyl)-benzoic Acid

7. 432106-71-3

8. Fendizoato

9. 2-{6-hydroxy-[1,1'-biphenyl]-3-carbonyl}benzoic Acid

10. Benzoic Acid, 2-[(6-hydroxy[1,1'-biphenyl]-3-yl)carbonyl]-

11. Schembl9455577

12. Chembl2104248

13. Dtxsid20276528

14. Akos015855850

15. Ac-37175

16. Db-090874

17. 2-(4'-hydroxy-3'-phenylbenzoyl)benzoic Acid

18. E85381

19. En300-7435037

20. 2-[(2'-hydroxy-5'-bi-phenylyl)carbonyl]benzoic Acid

21. 2-[(6-hydroxy-biphenyl-3-yl)carbonyl]-benzoic Acid

22. 2-(6-hydroxy-[1,1''-biphenyl]-3-carbonyl)benzoicacid

23. 2-(6-hydroxy-[1,1'-biphenyl]-3-carbonyl)benzoicacid

24. Z2681890932

25. 2-[(6-hydroxy[1,1'-biphenyl]-3-yl)carbonyl]benzoic Acid; O-[(6-hydroxy-3-biphenylyl)carbonyl]benzoic Acid; 2-(3'-phenyl-4'-hydroxybenzoyl)benzoic Acid

2.3 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 318.3 g/mol
Molecular Formula C20H14O4
XLogP34.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass Da
Monoisotopic Mass Da
Topological Polar Surface Area74.6
Heavy Atom Count24
Formal Charge0
Complexity455
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1