CAS 2235-00-9

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Also known as: 1-vinylazepan-2-one, 2235-00-9, 1-ethenylazepan-2-one, N-vinyl-epsilon-caprolactam, 2h-azepin-2-one, 1-ethenylhexahydro-, 25189-83-7

Molecular Formula

C₈H₁₃NO

Molecular Weight

139.19 g/mol

InChI Key

JWYVGKFDLWWQJX-UHFFFAOYSA-N

FDA UNII

KFC10CY9UP

1 2D Structure

CAS 2235-00-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-ethenylazepan-2-one

2.1.2 InChI

InChI=1S/C8H13NO/c1-2-9-7-5-3-4-6-8(9)10/h2H,1,3-7H2

2.1.3 InChI Key

JWYVGKFDLWWQJX-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C=CN1CCCCCC1=O

2.2 Other Identifiers

2.2.1 UNII

KFC10CY9UP

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Oligo(n-vinylcaprolactam)

2. Poly(n-vinylcaprolactam)

3. Poly-n-vinylcaprolactam

2.3.2 Depositor-Supplied Synonyms

1. 1-vinylazepan-2-one

2. 2235-00-9

3. 1-ethenylazepan-2-one

4. N-vinyl-epsilon-caprolactam

5. 2h-azepin-2-one, 1-ethenylhexahydro-

6. 25189-83-7

7. N-vinyl Caprolactam

8. 2h-azepin-2-one, 1-ethenylhexahydro-, Homopolymer

9. Kfc10cy9up

10. Dtxsid1041423

11. Poly-n-vinylcaprolactam

12. 1-vinylhexahydro-2h-azepin-2-one

13. Poly(n-vinylcaprolactam)

14. Oligo(n-vinylcaprolactam)

15. 1-ethenylhexahydro-2h-azepin-2-one

16. Unii-kfc10cy9up

17. Einecs 218-787-6

18. N-vinyl-e-caprolactam

19. V-cap Rc

20. 1-vinylcaprolactam

21. N-vinyl-micro-caprolactam

22. N-vinylcaprolactam, 98%

23. Ec 218-787-6

24. 1-vinylperhydroazepin-2-one

25. Dsstox_cid_21423

26. Dsstox_rid_79727

27. N-vinylazepan-2-one

28. Dsstox_gsid_41423

29. Schembl26239

30. N-vinyl-.epsilon.-caprolactam

31. 1-vinyl-perhydro-azepin-2-one

32. Vinyl Caprolactam (vcl)

33. Chembl3188330

34. Zinc395596

35. N-vinyl Caprolactam [inci]

36. Caa23500

37. Tox21_301124

38. Mfcd00080693

39. Akos009156746

40. Ncgc00248298-01

41. Ncgc00255023-01

42. 1-vinylhexahydro-2h-azepin-2-one;1-ethenylazepan-2-one;2h-azepin-2-one, 1-ethenylhexahydro-;2h-azepin-2-one, Hexahydro-1-vinyl-;1-vinylazepan-2-one;1-vinylhexahydro-2h-azepin-2-one 1-ethenylazepan-2-one 2h-azepin-2-one, 1-ethenylhexahydro- 2h-azepin-2-one, Hexahydro-1-vinyl- 1-vinylazepan-2-one

43. Ac-14390

44. As-57151

45. Cas-2235-00-9

46. Cs-0077097

47. Ft-0768040

48. V0073

49. 2h-azepin-2-one, Hexahydro-1-vinyl-

50. E78936

51. A878587

52. Q-101292

53. Q15712394

54. N-vinyl-epsilon-caprolactam (stabilized With Ho-tempo)

55. N-vinylcaprolactam; 1-ethenylazepan-2-one; 1-vinylhexahydro-2h-azepin-2-one; 1-ethenylhexahydro-2h-azepin-2-one

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₈H₁₃NO
Molecular Weight	139.19 g/mol
XLogP3	1.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	139.099714038 g/mol
Monoisotopic Mass	139.099714038 g/mol
Topological Polar Surface Area	20.3 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	142
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

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