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Also known as: 2-methylquinolin-8-ol, 826-81-3, 2-methyl-8-quinolinol, 2-methyl-8-hydroxyquinoline, 8-quinolinol, 2-methyl-, 8-hydroxy-2-methylquinoline
Molecular Formula
C10H9NO
Molecular Weight
159.18  g/mol
InChI Key
NBYLBWHHTUWMER-UHFFFAOYSA-N
FDA UNII
7W631H5302

CAS 826-81-3
1 2D Structure

CAS 826-81-3

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-methylquinolin-8-ol
2.1.2 InChI
InChI=1S/C10H9NO/c1-7-5-6-8-3-2-4-9(12)10(8)11-7/h2-6,12H,1H3
2.1.3 InChI Key
NBYLBWHHTUWMER-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=NC2=C(C=CC=C2O)C=C1
2.2 Other Identifiers
2.2.1 UNII
7W631H5302
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 2-methyl-8-hydroxyquinoline

2.3.2 Depositor-Supplied Synonyms

1. 2-methylquinolin-8-ol

2. 826-81-3

3. 2-methyl-8-quinolinol

4. 2-methyl-8-hydroxyquinoline

5. 8-quinolinol, 2-methyl-

6. 8-hydroxy-2-methylquinoline

7. 2-methyloxine

8. Hydroxyquinaldine

9. 8-hydroxyqinaldine

10. 2-methyl-quinolin-8-ol

11. Chembl316892

12. Nsc-58553

13. 7w631h5302

14. 2-methyl 8-quinolinol

15. Nsc-403349

16. 8-hydroxyquinaldine (8-hydroxy-2-methylquinoline)

17. Einecs 212-562-6

18. Nsc 58553

19. Brn 0119194

20. 2-methyl-oxine

21. Unii-7w631h5302

22. 8-hydroxy-quinaldine

23. Mfcd00006765

24. Ec 212-562-6

25. 8-hydroxy Quinaldine

26. 5-21-03-00341 (beilstein Handbook Reference)

27. Schembl297247

28. 2-methyl-8-quinolinol, 98%

29. Dtxsid3061184

30. Chebi:180510

31. Hms1647n13

32. Act10324

33. Nsc58553

34. Bdbm50065785

35. Stk037617

36. Zinc12341384

37. Akos000121472

38. Cs-w004053

39. Fs-2928

40. Hydroxy-2-methylquinoline, 8-

41. Sb67453

42. Ncgc00188188-01

43. Ac-12780

44. Am804380

45. Db-056646

46. Ft-0621549

47. M0420

48. P20524

49. W-104165

50. Q27268939

51. F0001-2119

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 159.18 g/mol
Molecular Formula C10H9NO
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass159.068413911 g/mol
Monoisotopic Mass159.068413911 g/mol
Topological Polar Surface Area33.1 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

BUILDING BLOCK

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