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Also known as: 70918-74-0, N-(1,4-benzodioxan-2-carbonyl)piperazine hydrochloride, 2-(1-piperazinylcarbonyl)-1,4-benzodioxane hydrochloride, (2,3-dihydrobenzo[b][1,4]dioxin-2-yl)(piperazin-1-yl)methanone hydrochloride, N-[(1,4-benzodioxane-2-yl)carboxyl] piperazine hydrochloride, 2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-1-yl)methanone;hydrochloride
Molecular Formula
C13H17ClN2O3
Molecular Weight
284.74  g/mol
InChI Key
TUKBWYXLYINULI-UHFFFAOYSA-N

CAS 70918-74-0
1 2D Structure

CAS 70918-74-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-1-yl)methanone;hydrochloride
2.1.2 InChI
InChI=1S/C13H16N2O3.ClH/c16-13(15-7-5-14-6-8-15)12-9-17-10-3-1-2-4-11(10)18-12;/h1-4,12,14H,5-9H2;1H
2.1.3 InChI Key
TUKBWYXLYINULI-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CN(CCN1)C(=O)C2COC3=CC=CC=C3O2.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 70918-74-0

2. N-(1,4-benzodioxan-2-carbonyl)piperazine Hydrochloride

3. 2-(1-piperazinylcarbonyl)-1,4-benzodioxane Hydrochloride

4. (2,3-dihydrobenzo[b][1,4]dioxin-2-yl)(piperazin-1-yl)methanone Hydrochloride

5. N-[(1,4-benzodioxane-2-yl)carboxyl] Piperazine Hydrochloride

6. 2,3-dihydro-1,4-benzodioxin-3-yl(piperazin-1-yl)methanone;hydrochloride

7. N-(1,4-benzodioxan-2-carbonyl)-piperazine Hydrochloride

8. N-(2,3-dihydro-1,4-benzodioxane-2-carbonyl)piperazine Hydrochloride

9. (2,3-dihydro-benzo[1,4]dioxin-2-yl)-piperazin-1-yl-methanone Hcl

10. (2,3-dihydro-benzo[1,4]dioxin-2-yl)-piperazin-1-yl-methanone Hydrochloride

11. (2,3-dihydro-benzo[1,4]dioxin-2-yl)piperazine-1-yl-methanone Hydrochloride

12. N-[(1,4-benzodioxane-2-yl)carbonyl]piperazine Hydrochloride

13. (2,3-dihydrobenzo[1,4]dioxin-2-yl)piperazin-1-yl-methanone Hydrochloride

14. 1-[(2rs)-2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl]piperazine Hydrochloride

15. Doxazosin Related Compou

16. Ec 415-660-9

17. Schembl8335181

18. 2-(1-piperazinylcarbonyl)-1,4-benzodioxanehydrochloride

19. 1-(1,4-benzodioxan-2-ylcarbonyl)piperazine Hydrochloride

20. Dtxsid00384918

21. Bcp13416

22. 1-(23-dihydro-14-benzodioxin-2-ylcarbonyl)piperazine Hydrochloride

23. Mfcd00729051

24. P8b773

25. Akos015889671

26. Ac-6854

27. Cs-w002671

28. As-35636

29. Doxazosin Ep Impurity B Monohydrochloride

30. 1,4-benzodioxan-2-carbonyl Piperazine Hcl

31. Ft-0641316

32. P1890

33. N-(1,4-benzodioxan-2-carbonyl)-piperazine Hcl

34. N-(1,4-benzodioxan-2-carbonyl)piperazinehydrochloride

35. 1-[(1,4-benzodioxan-2-yl)carbonyl]piperazine Hydrochloride

36. N-[(1,4-benzodioxane-2-yl)carboxyl]piperazine Hydrochloride

37. 1-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazine Hydrochloride;

38. 1-[(2,3-dihydro-1,4-benzodioxin-2-yl)-carbonyl]-piperazine Hydrochloride

39. (2,3-dihydro-1,4-benzodioxin-2-yl)(piperazin-1-yl)methanone--hydrogen Chloride (1/1)

40. 1-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazine Hydrochloride, Aldrichcpr

41. Methanone, (2,3-dihydro-1,4-benzodioxin-2-yl)-1-piperazinyl-, Hydrochloride

2.3 Create Date
2005-07-19
3 Chemical and Physical Properties
Molecular Weight 284.74 g/mol
Molecular Formula C13H17ClN2O3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass284.0927701 g/mol
Monoisotopic Mass284.0927701 g/mol
Topological Polar Surface Area50.8 Ų
Heavy Atom Count19
Formal Charge0
Complexity305
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

BUILDING BLOCK

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