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Also known as: 100939-96-6, 1-(2-methoxylphenyl)-piperazine monohydrobromide, 1-(2-methoxylphenyl)piperazine hydrobromide, 2-meopp hbr, Piperazine, 1-(2-methoxyphenyl)-, monohydrobromide, N-(2-methoxyphenyl)piperazine hydrobromide
Molecular Formula
C11H17BrN2O
Molecular Weight
273.17  g/mol
InChI Key
QPAHBXFXDDEKNB-UHFFFAOYSA-N
FDA UNII
2N1ZY78316

CAS 100939-96-6
1 2D Structure

CAS 100939-96-6

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-(2-methoxyphenyl)piperazine;hydrobromide
2.1.2 InChI
InChI=1S/C11H16N2O.BrH/c1-14-11-5-3-2-4-10(11)13-8-6-12-7-9-13;/h2-5,12H,6-9H2,1H3;1H
2.1.3 InChI Key
QPAHBXFXDDEKNB-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=CC=CC=C1N2CCNCC2.Br
2.2 Other Identifiers
2.2.1 UNII
2N1ZY78316
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 100939-96-6

2. 1-(2-methoxylphenyl)-piperazine Monohydrobromide

3. 1-(2-methoxylphenyl)piperazine Hydrobromide

4. 2-meopp Hbr

5. Piperazine, 1-(2-methoxyphenyl)-, Monohydrobromide

6. N-(2-methoxyphenyl)piperazine Hydrobromide

7. 1-(2-methoxylphenyl)-piperazine Hydrobromide

8. 1-(2-methoxyphenyl)piperazine;hydrobromide

9. Piperazine, 1-o-anisyl-, -hbr

10. 2n1zy78316

11. Piperazine, 1-(2-methoxyphenyl)-, Hydrobromide (1:1)

12. 10093-96-6

13. 1-(2-methoxyphenyl-piperazine) Monohydrobromide

14. Unii-2n1zy78316

15. Dtxsid40641012

16. 1-(2-methoxyphenyl)piperazine Hbr

17. Amy32503

18. Bcp11123

19. Mfcd00450303

20. Akos007930144

21. Ac-26438

22. As-10762

23. Db-018449

24. Cs-0329905

25. Ft-0602258

26. 1-(2-methoxyphenyl-piperazine)monohydrobromide

27. E79160

28. 939m966

29. A800302

30. J-000281

31. Q27255037

32. 1-(2-methoxyphenyl)piperazine--hydrogen Bromide (1/1)

33. 1-(2-methoxyphenyl)piperazine Hydrobromide;1-(2-methoxylphenyl)-piperazine Monohydrobromide

2.4 Create Date
2008-02-29
3 Chemical and Physical Properties
Molecular Weight 273.17 g/mol
Molecular Formula C11H17BrN2O
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass272.05243 g/mol
Monoisotopic Mass272.05243 g/mol
Topological Polar Surface Area24.5 Ų
Heavy Atom Count15
Formal Charge0
Complexity169
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

BUILDING BLOCK

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