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Also known as: 62978-73-8, 5-acetyl-8-hydroxyquinolin-2(1h)-one, 5-acetyl-quinoline-2,8-diol, 5-acetyl-8-hydroxy-1,2-dihydroquinolin-2-one, 5-acetyl-8-hydroxy-2(1h)-quinolinone, 1-(2,8-dihydroxyquinolin-5-yl)ethanone
Molecular Formula
C11H9NO3
Molecular Weight
203.19  g/mol
InChI Key
PJVZAXRWCFBQFH-UHFFFAOYSA-N

62978-73-8
1 2D Structure

62978-73-8

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
5-acetyl-8-hydroxy-1H-quinolin-2-one
2.1.2 InChI
InChI=1S/C11H9NO3/c1-6(13)7-2-4-9(14)11-8(7)3-5-10(15)12-11/h2-5,14H,1H3,(H,12,15)
2.1.3 InChI Key
PJVZAXRWCFBQFH-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(=O)C1=C2C=CC(=O)NC2=C(C=C1)O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 62978-73-8

2. 5-acetyl-8-hydroxyquinolin-2(1h)-one

3. 5-acetyl-quinoline-2,8-diol

4. 5-acetyl-8-hydroxy-1,2-dihydroquinolin-2-one

5. 5-acetyl-8-hydroxy-2(1h)-quinolinone

6. 1-(2,8-dihydroxyquinolin-5-yl)ethanone

7. 5-acetyl-8-hydroxy-2(h)-quinolinone

8. Schembl99398

9. 5-acetylquinoline-2,8-diol

10. 5-acetyl-8-hydroxycarbostyril

11. Boc-d-glutamicacid1-benzylester

12. Chembl4067630

13. 5-acetyl-8-hydroxy-2-quinolone

14. Dtxsid50475168

15. Pjvzaxrwcfbqfh-uhfffaoysa-n

16. Amy16080

17. Mfcd08061148

18. Akos015991345

19. Ac-9102

20. Df-0723

21. Sb69366

22. 5-acetyl-8-hydroxy-(1h)-quinolin-2-one

23. 5-acetyl-quinoline-2,8-diol, Aldrichcpr

24. Cs-0054948

25. Ft-0647962

26. A13896

27. J-516627

2.3 Create Date
2007-01-10
3 Chemical and Physical Properties
Molecular Weight 203.19 g/mol
Molecular Formula C11H9NO3
XLogP30.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area66.4
Heavy Atom Count15
Formal Charge0
Complexity324
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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