CAS 1126-09-6

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Also known as: 1126-09-6, Ethyl piperidine-4-carboxylate, Ethyl isonipecotate, Piperidine-4-carboxylic acid ethyl ester, 4-piperidinecarboxylic acid, ethyl ester, Ethylpiperidine-4-carboxylate

Molecular Formula

C₈H₁₅NO₂

Molecular Weight

157.21 g/mol

InChI Key

RUJPPJYDHHAEEK-UHFFFAOYSA-N

1 2D Structure

CAS 1126-09-6

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

ethyl piperidine-4-carboxylate

2.1.2 InChI

InChI=1S/C8H15NO2/c1-2-11-8(10)7-3-5-9-6-4-7/h7,9H,2-6H2,1H3

2.1.3 InChI Key

RUJPPJYDHHAEEK-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC(=O)C1CCNCC1

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1126-09-6

2. Ethyl Piperidine-4-carboxylate

3. Ethyl Isonipecotate

4. Piperidine-4-carboxylic Acid Ethyl Ester

5. 4-piperidinecarboxylic Acid, Ethyl Ester

6. Ethylpiperidine-4-carboxylate

7. Mfcd00006003

8. Isonipecotic Acid Ethyl Ester

9. Ethylisonipecotate

10. 4-piperidinecarboxylic Acid Ethyl Ester

11. 4-carbethoxypiperidine

12. 4-carboethoxypiperidine

13. 4-(ethoxycarbonyl)piperidine

14. Einecs 214-416-7

15. A-ethyl Isonipecotate

16. 4-ethoxycarbonylpiperidine

17. 4-ethoxycarbonyl Piperadine

18. 4-ethoxycarbonyl Piperidine

19. Ethyl Isonipecotate, 98%

20. Oprea1_864652

21. Schembl27886

22. Ethyl Piperid-4-ylcarboxylate

23. Ethyl Piperidin-4-carboxylate

24. Ethyl 4-piperidine Carboxylate

25. Ethyl 4-piperidine-carboxylate

26. Ethyl Piperadine-4-carboxylate

27. Ethyl Piperdin-4-ylcarboxylate

28. Ethyl Piperidine 4-carboxylate

29. Ethyl-4-piperidine Carboxylate

30. Ethyl Piperidin-4-ylcarboxylate

31. Chembl2251608

32. Dtxsid90150109

33. Piperidine-4-carboxylic Acid Ethyl

34. Act04189

35. Bcp27137

36. Nsc93792

37. Str02241

38. Zinc3860448

39. Bbl008541

40. Nsc 93792

41. Nsc-93792

42. Stk260860

43. Akos000119792

44. Ac-2523

45. Cs-w009052

46. Piperidine-4-carboxylic Acid Ethylester

47. Piperidine-4carboxylic Acid Ethyl Ester

48. Sb42922

49. Sdccgmls-0066232.p001

50. 4-piperidine-carboxylic Acid Ethyl Ester

51. Sy001812

52. Sy278371

53. Ts-02094

54. Db-007507

55. Am20080077

56. Ft-0600591

57. I0294

58. En300-19517

59. P20835

60. W-108644

61. F2190-0332

62. Methyl Piperidine-4-carboxylate Pound Hydrochloride Pound(c)

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₈H₁₅NO₂
Molecular Weight	157.21 g/mol
XLogP3	0.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	38.3
Heavy Atom Count	11
Formal Charge	0
Complexity	130
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	1