CAS 13220-33-2

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Also known as: 13220-33-2, 1-methylpyrrolidin-3-ol, 3-hydroxy-1-methylpyrrolidine, N-methyl-3-pyrrolidinol, 3-pyrrolidinol, 1-methyl-, 3-hydroxy-n-methylpyrrolidine

Molecular Formula

C₅H₁₁NO

Molecular Weight

101.15 g/mol

InChI Key

FLVFPAIGVBQGET-UHFFFAOYSA-N

FDA UNII

CGW2AL7PQ7

1 2D Structure

CAS 13220-33-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-methylpyrrolidin-3-ol

2.1.2 InChI

InChI=1S/C5H11NO/c1-6-3-2-5(7)4-6/h5,7H,2-4H2,1H3

2.1.3 InChI Key

FLVFPAIGVBQGET-UHFFFAOYSA-N

2.2 Other Identifiers

2.2.1 UNII

CGW2AL7PQ7

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 13220-33-2

2. 1-methylpyrrolidin-3-ol

3. 3-hydroxy-1-methylpyrrolidine

4. N-methyl-3-pyrrolidinol

5. 3-pyrrolidinol, 1-methyl-

6. 3-hydroxy-n-methylpyrrolidine

7. Unii-cgw2al7pq7

8. Cgw2al7pq7

9. N-methyl-3-hydroxypyrrolidine

10. Einecs 236-189-3

11. Nsc 89279

12. Nsc-89279

13. 1-methyl-3-hydroxypyrrolidine

14. Dtxsid10864377

15. 1methylpyrrolidin3ol

16. Refchem:76288

17. 3hydroxy1methylpyrrolidine

18. Dtxcid40812902

19. Flvfpaigvbqget-uhfffaoysa-n

20. Mfcd00003176

21. 99445-21-3

22. Chembl4752499

23. 1-methyl-pyrrolidin-3-ol

24. Nsc89279

25. L-methyl-3-pyrrolidinol

26. 1-methyl-pyrrolidin-3ol

27. N-methyl-pyrrolidin-3-ol

28. Glycopyrrolate Impurity 50

29. 3-hydroxy-1-methylpyrroldine

30. Schembl129605

31. Schembl187882

32. Schembl357596

33. Schembl689829

34. Orb3030217

35. Schembl8706794

36. Schembl18277801

37. Schembl19329720

38. Schembl19329735

39. 1-methyl-3-pyrrolidinol, 95%

40. Cs-m2838

41. Hy-i0708

42. Bdbm50561631

43. Akos009157110

44. Ac-6615

45. Ebc-459104

46. Fm11436

47. Pb17320

48. Pb32059

49. Sb10211

50. Sb10212

51. As-11358

52. Sy005849

53. Db-014286

54. Db-361411

55. M2115

56. Ns00051700

57. En300-204124

58. 220h332

59. F040009

60. 3-hydroxy-1-methylpyrrolidine;n-methyl-3-pyrrolidinol

61. Q27275454

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₅H₁₁NO
Molecular Weight	101.15 g/mol
XLogP3	-0.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	23.5
Heavy Atom Count	7
Formal Charge	0
Complexity	65.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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