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Also known as: 67004-64-2, 2-(1-methylpyrrolidin-2-yl)ethanol, 1-methyl-2-pyrrolidine ethanol, 2-pyrrolidineethanol, 1-methyl-, 2-(2-hydroxyethyl)-1-methylpyrrolidine, 2-(1-methylpyrrolidin-2-yl)ethan-1-ol
Molecular Formula
C7H15NO
Molecular Weight
129.20  g/mol
InChI Key
FYVMBPXFPFAECB-UHFFFAOYSA-N
FDA UNII
46PY6SCZ39

CAS 67004-64-2
1 2D Structure

CAS 67004-64-2

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-(1-methylpyrrolidin-2-yl)ethanol
2.1.2 InChI
InChI=1S/C7H15NO/c1-8-5-2-3-7(8)4-6-9/h7,9H,2-6H2,1H3
2.1.3 InChI Key
FYVMBPXFPFAECB-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CN1CCCC1CCO
2.2 Other Identifiers
2.2.1 UNII
46PY6SCZ39
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 67004-64-2

2. 2-(1-methylpyrrolidin-2-yl)ethanol

3. 1-methyl-2-pyrrolidine Ethanol

4. 2-pyrrolidineethanol, 1-methyl-

5. 2-(2-hydroxyethyl)-1-methylpyrrolidine

6. 2-(1-methylpyrrolidin-2-yl)ethan-1-ol

7. 2-(1-methyl-2-pyrrolidine)ethanol

8. 46py6scz39

9. Mfcd00003174

10. Einecs 266-538-5

11. Unii-46py6scz39

12. 1-methylpyrrolidine-2-ethanol

13. N-methyl-2-(2-hydroxyethyl)pyrrolidine

14. Schembl236633

15. Dtxsid40985827

16. (r)-1-methyl-2-pyrrolidineethanol

17. (s)-1-methyl-2-pyrrolidineethanol

18. Albb-021943

19. Bcp13364

20. (+)-1-methyl-2-pyrrolidineethanol

21. (?)-1-methyl-2-pyrrolidineethanol

22. 2-(n-methylpyrrolidin-2-yl)ethanol

23. 2-(1-methyl-2-pyrrolidinyl)ethanol

24. Stl387994

25. 2-(1-methylpyrrolidin-2-yl)-ethanol

26. Akos009156387

27. 1-methyl-2-pyrrolidine Ethanol, 98%

28. Cs-w013446

29. Sb13461

30. Sb13462

31. Sb13463

32. 2-(1-methyl-2-pyrrolidinyl)ethanol #

33. 2-(1-methyl-pyrrolidin-2-yl)-ethanol

34. 2-(2-hydroxyethyl)-n-methylpyrrolidine

35. N-methyl-2-(2-hydroxylethyl)pyrrolidine

36. Ac-15702

37. As-15528

38. Sy014916

39. Db-054981

40. A9005

41. Ft-0608477

42. M0908

43. En300-52526

44. 1-methyl-2-pyrrolidineethanol, (+/-)-

45. 004m642

46. Q-200127

47. Q27258948

48. Z1245634049

2.4 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 129.20 g/mol
Molecular Formula C7H15NO
XLogP30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass129.115364102 g/mol
Monoisotopic Mass129.115364102 g/mol
Topological Polar Surface Area23.5 Ų
Heavy Atom Count9
Formal Charge0
Complexity85
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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