CAS 7250-67-1

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Also known as: 7250-67-1, N-(2-chloroethyl)pyrrolidine hydrochloride, 2-chloroethylpyrrolidine hydrochloride, 2-pyrrolidinoethyl chloride hydrochloride, Pyrrolidine, 1-(2-chloroethyl)-, hydrochloride, 7050-67-1

Molecular Formula

C₆H₁₃Cl₂N

Molecular Weight

170.08 g/mol

InChI Key

FSNGFFWICFYWQC-UHFFFAOYSA-N

FDA UNII

YYQ1H343R5

1 2D Structure

CAS 7250-67-1

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-(2-chloroethyl)pyrrolidine;hydrochloride

2.1.2 InChI

InChI=1S/C6H12ClN.ClH/c7-3-6-8-4-1-2-5-8;/h1-6H2;1H

2.1.3 InChI Key

FSNGFFWICFYWQC-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CCN(C1)CCCl.Cl

2.2 Other Identifiers

2.2.1 UNII

YYQ1H343R5

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 7250-67-1

2. N-(2-chloroethyl)pyrrolidine Hydrochloride

3. 2-chloroethylpyrrolidine Hydrochloride

4. 2-pyrrolidinoethyl Chloride Hydrochloride

5. Pyrrolidine, 1-(2-chloroethyl)-, Hydrochloride

6. 7050-67-1

7. Mfcd00012718

8. 1-(2-chloroethyl)pyrrolidine.hcl

9. 1-(2-chloroethyl)pyrrolidine Hcl

10. 1-(2-chloroethyl)pyrrolidine, Hcl

11. Yyq1h343r5

12. Nsc-30132

13. Pyrrolidinoethyl Chloride, Hydrochloride

14. Einecs 230-660-7

15. Nsc 30132

16. Unii-yyq1h343r5

17. 1-(2-chloroethyl)pyrrolidinehydrochloride

18. 1-(2-chloroethyl)pyrrolidine;hydrochloride

19. Chloroethylpyrrolidine.hcl

20. Schembl227968

21. Chembl4516939

22. Dtxsid8022248

23. 2-chloroethylpyrrolidine Hcl Salt

24. Amy4094

25. 1-(2-chloroethyl)pyrrolidine-hcl

26. 1-(2-chloroethyl)-pyrrolidine-hcl

27. 1-(2-chloroethyl)-pyrrolidine Hcl

28. Cs-d1148

29. Nsc30132

30. 2-chloroethylpyrrolidin Hydrochloride

31. N-chloroethylpyrrolidine Hydrochloride

32. 2-chloroethyl-pyrrolidine Hydrochloride

33. Akos009031294

34. N-chloroethyl Pyrrolidine Hydrochloride

35. Ac-8320

36. (2-chloroethyl)pyrrolidine Hydrochloride

37. 2-pyrrolidinylethylchloride Hydrochloride

38. N-2-chloroethylpyrrolidine Hydrochloride

39. 1-(2-chlorethyl)pyrrolidine Hydrochloride

40. 1-(2-chloroethyl)-pyrrolidinhydrochloride

41. Ac-17197

42. As-13399

43. Bp-10893

44. Da-19668

45. Sy013128

46. 1-(2-chloro-ethyl)-pyrrolidinium Chloride

47. 1-(2-chloroethyl) Pyrrolidine Hydrochloride

48. 1-(2-chloroethyl)-pyrrolidine Hydrochloride

49. 1-(2-chloroethyl)pyrrolidine, Hydrochloride

50. Db-006088

51. N-(2-chloroethyl) Pyrrolidine Hydrochloride

52. N-(2-chloroethyl)-pyrrolidine Hydrochloride

53. N-(2-chloroethyl)-pyrrolidine-hydrochloride

54. N-(2-chloroethyl)-pyrrolidine.hydrochloride

55. Ft-0605517

56. Ft-0713682

57. N-(2-chloroethyl)-pyrrolidine, Hydrochloride

58. 1-(2-chloro-ethyl)-pyrrolidine Hydrochloride

59. 1-(2-chloro-ethyl)-pyrrolidine-hydrochloride

60. 1-(2-chloroethyl)pyrrolidine Hydrochloride Salt

61. 1-(2-chloroethyl)pyrrolidine Hydrogen Chloride

62. A26566

63. 1-chloro-2-(1-pyrrolidinyl)ethane Hydrochloride

64. N-(2-chloroethyl) Tetrahydropyrrole Hydrochloride

65. N-(2-chloroethyl)tetrahydropyrrole Hydrochloride

66. 1-(2-chloroethyl)pyrrolidine Hydrochloride, 98%

67. 2-(pyrrolidin-1-yl)-1-chloroethane Hydrochloride

68. W-104485

69. Q27294792

70. F2190-0250

71. Pyrrolidine, 1-(2-chloroethyl)-, Hydrochloride (1:1)

72. Z285572146

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₆H₁₃Cl₂N
Molecular Weight	170.08 g/mol
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	169.0425048 g/mol
Monoisotopic Mass	169.0425048 g/mol
Topological Polar Surface Area	3.2 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	59.5
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2