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Also known as: 22246-18-0, 7-hydroxy-3,4-dihydroquinolin-2(1h)-one, 7-hydroxy-3,4-dihydro-2(1h)-quinolinone, 7-hydroxy-3,4-dihydro-1h-quinolin-2-one, 3,4-dihydro-7-hydroxycarbostyril, 7-hydroxy-3,4-dihydrocarbostyril
Molecular Formula
C9H9NO2
Molecular Weight
163.17  g/mol
InChI Key
LKLSFDWYIBUGNT-UHFFFAOYSA-N
FDA UNII
VFU6XCR3Q3

CAS 22246-18-0
1 2D Structure

CAS 22246-18-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
7-hydroxy-3,4-dihydro-1H-quinolin-2-one
2.1.2 InChI
InChI=1S/C9H9NO2/c11-7-3-1-6-2-4-9(12)10-8(6)5-7/h1,3,5,11H,2,4H2,(H,10,12)
2.1.3 InChI Key
LKLSFDWYIBUGNT-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC(=O)NC2=C1C=CC(=C2)O
2.2 Other Identifiers
2.2.1 UNII
VFU6XCR3Q3
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 22246-18-0

2. 7-hydroxy-3,4-dihydroquinolin-2(1h)-one

3. 7-hydroxy-3,4-dihydro-2(1h)-quinolinone

4. 7-hydroxy-3,4-dihydro-1h-quinolin-2-one

5. 3,4-dihydro-7-hydroxycarbostyril

6. 7-hydroxy-3,4-dihydrocarbostyril

7. 7-hydroxy-3,4-dihydro-quinolin-2-one

8. 3,4-dihydroquinoline-2,7-diol

9. 2(1h)-quinolinone, 3,4-dihydro-7-hydroxy-

10. Vfu6xcr3q3

11. Chembl2430711

12. Mfcd06410891

13. 3,4-dihydro-7-hydroxy-2(1h)-quinoline

14. 3,4-dihydro-7-hydroxyquinoline-2(1h)-one

15. 7-hydroxy-1,2,3,4-tetrahydroquinolin-2-one

16. 7-oxidanyl-3,4-dihydro-1~{h}-quinolin-2-one

17. 7-hydroxy-3,4-dihydro Carbostyril

18. Unii-vfu6xcr3q3

19. Aripiprazole Impurity 13

20. Aripiprazole Ep Impurity A

21. Schembl8751

22. Aripiprazole Impurity A [ep]

23. Dtxsid70382941

24. 7-hydroxy-3,4-dihydro-carbostyril

25. Bcp27862

26. Zinc3957997

27. Bbl011056

28. Bdbm50493470

29. S4767

30. Stk617335

31. Stk802230

32. Akos005551353

33. Akos005622540

34. Ab25068

35. Ac-7028

36. Ccg-266302

37. Cs-w010846

38. Fd18013

39. Gf-0122

40. Hy-w010130

41. Sy009657

42. 7-hydroxy-3,4-dihydro-1h-quinoline-2-one

43. 7-hydroxy-3,4-dihydro-2(1h)-quinolineone

44. 7-hydroxy-3,4-dihydro-quinolin-2(1h)-one

45. Am20060553

46. Aripiprazole Impurity A [ep Impurity]

47. D3599

48. Ft-0601230

49. 1,2,3,4-tetrahydroquinoline -7 -ol-2-one

50. 7-(hydroxyl)-3,4-dihydroquinolin-2(1h)-one

51. 7-hydroxy-1,2,3,4-tetrahydroquinoline-2-one

52. 7-hydroxy-2-oxo-1,2,3,4-tetrahydroquinoline

53. 246h180

54. 3,4-dihydro-7-hydroxyquinolin-2(1h)-one

55. 3,4-dihydro-7-hydroxyquinoline-2(1h)-one-[d6]

56. 7-hydroxy-3,4-dihydro-2(1h)-quinolinone, 97%

57. A816050

58. J-511190

59. 7-hydroxy-3,4-dihydroquinolin-2(1h)-one;7-hydroxy-3,4-dihydro Carbostyril;7-hydroxy-3,4-dihydro-2(1h)-quinolinone;7-hydroxy-2-oxo-1,2,3,4-tetrahydroquinoline;

60. 8hj

61. Aripiprazole Dihydro Quinolinone Impurity (usp); 7-hydroxycarbostyril; 3,4-dihydro-7-hydroxy-2(1h)-quinolinone; 7-hydroxy-3,4-dihydroquinolin-2(1h)-one

2.4 Create Date
2005-07-19
3 Chemical and Physical Properties
Molecular Weight 163.17 g/mol
Molecular Formula C9H9NO2
XLogP30.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass163.063328530 g/mol
Monoisotopic Mass163.063328530 g/mol
Topological Polar Surface Area49.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity193
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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