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CAS 85908-96-9
Also known as: 85908-96-9, N-boc-2-piperidone, 1-boc-2-piperidone, 1-n-boc-2-piperidone, N-boc-piperidone, N-(tert-butoxycarbonyl)piperidin-2-one
Molecular Formula
C10H17NO3
Molecular Weight
199.25  g/mol
InChI Key
ULMHMJAEGZPQRY-UHFFFAOYSA-N

1 2D Structure

CAS 85908-96-9

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
tert-butyl 2-oxopiperidine-1-carboxylate
2.1.2 InChI
InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-7-5-4-6-8(11)12/h4-7H2,1-3H3
2.1.3 InChI Key
ULMHMJAEGZPQRY-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(C)(C)OC(=O)N1CCCCC1=O
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 85908-96-9

2. N-boc-2-piperidone

3. 1-boc-2-piperidone

4. 1-n-boc-2-piperidone

5. N-boc-piperidone

6. N-(tert-butoxycarbonyl)piperidin-2-one

7. Mfcd02179046

8. 1-(tert-butoxycarbonyl)-2-piperidone

9. Tert-butyl 2-oxo-1-piperidinecarboxylate

10. 1-piperidinecarboxylic Acid, 2-oxo-, 1,1-dimethylethyl Ester

11. Boc-piperidinone

12. N-boc Piperidone

13. 1-boc-piperidone

14. N-boc Piperidinone

15. N-boc-piperidinone

16. 1-boc-piperidinone

17. 1-boc-2-oxopiperidine

18. N-t-butoxycarbonylpiperidone

19. Schembl42476

20. N-tert-butoxycarbonyl Piperidone

21. N-tert-butoxycarbonylvalerolactam

22. N-tert-butyloxycarbonylpiperidone

23. 1-n-boc-2-piperidone, 97%

24. Chebi:59556

25. Dtxsid40428825

26. N-(tert-butoxycarbonyl)piperidone

27. Albb-009361

28. Bcp23390

29. Zinc5240121

30. Ab3494

31. Stk505866

32. Akos005146158

33. Ac-7703

34. Cs-w008882

35. Gs-3288

36. Sb42947

37. N-tert-butoxycarbonyl-delta-valerolactam

38. 1-(tert-butoxycarbonyl)piperidine-2-one

39. Sy017440

40. Db-031473

41. Am20110234

42. B3788

43. Bb 0255193

44. Ft-0601676

45. En300-67592

46. 1-(tert-butoxycarbonyl)-1-azacyclohexan-2-one

47. 1,1-dimethylethyl 2-oxo-1-piperidinecarboxylate

48. 2-oxopiperidine-1-carboxylic Acid Tert-butyl Ester

49. 908b969

50. 2-oxo-1-piperidinecarboxylic Acid Tert-butyl Ester

51. 2-oxo-piperidine-1-carboxylic Acid Tert-butyl Ester

52. W-203958

53. Q27126776

54. Z1268703719

55. 2-oxo-1-piperidinecarboxylic Acid, 1,1-dimethylethyl Ester

2.3 Create Date
2006-07-29
3 Chemical and Physical Properties
Molecular Weight 199.25 g/mol
Molecular Formula C10H17NO3
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass199.12084340 g/mol
Monoisotopic Mass199.12084340 g/mol
Topological Polar Surface Area46.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity242
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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Syntame is a Pharm- Heatlh technology company jointly sponsored by two PhD from Hong Kong Polytechnic Uni...
Syntame is a Pharm- Heatlh technology company jointly sponsored by two PhD from Hong Kong Polytechnic University & Zhejiang University. We always focus on the market & customer needs, committee to researching, developing & marketing innovative products & services of pharmaceutical & health. Our Pharmaceutical Division: Committed to the R&D, promotion, distribution of APIs & intermediates, to provide various innovative products & technical solutions for China & global pharmaceutical markets. Our Health Division: Continuously tapping the natural active ingredients, combining traditional Chinese medicine theory, to develop functional foods.
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Syntame is a Pharm- Heatlh technology company jointly sponsored by two PhD from Hong Kong Polytechnic Uni...
Syntame is a Pharm- Heatlh technology company jointly sponsored by two PhD from Hong Kong Polytechnic University & Zhejiang University. We always focus on the market & customer needs, committee to researching, developing & marketing innovative products & services of pharmaceutical & health. Our Pharmaceutical Division: Committed to the R&D, promotion, distribution of APIs & intermediates, to provide various innovative products & technical solutions for China & global pharmaceutical markets. Our Health Division: Continuously tapping the natural active ingredients, combining traditional Chinese medicine theory, to develop functional foods.
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Syntame is a Pharm- Heatlh technology company jointly sponsored by two PhD from Hong Kong Polytechnic Uni...
Syntame is a Pharm- Heatlh technology company jointly sponsored by two PhD from Hong Kong Polytechnic University & Zhejiang University. We always focus on the market & customer needs, committee to researching, developing & marketing innovative products & services of pharmaceutical & health. Our Pharmaceutical Division: Committed to the R&D, promotion, distribution of APIs & intermediates, to provide various innovative products & technical solutions for China & global pharmaceutical markets. Our Health Division: Continuously tapping the natural active ingredients, combining traditional Chinese medicine theory, to develop functional foods.
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