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CAS 10045-25-7 manufacturers and suppliers on PharmaCompass

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CAS 10045-25-7
Also known as: 10045-25-7, Cyclen tetrahydrochloride, Tetraaza-12-crown-4 tetrahydrochloride, 1,4,7,10-tetraazacyclododecane, tetrahydrochloride, Cyclen tetrahydrochloride [mi], 1,4,7,10-tetraazacyclododecane, hydrochloride (1:4)
Molecular Formula
C8H24Cl4N4
Molecular Weight
318.1  g/mol
InChI Key
SBWLCGZEBQGYRP-UHFFFAOYSA-N
FDA UNII
51830Y7TIX

1 2D Structure

CAS 10045-25-7

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1,4,7,10-tetrazacyclododecane;tetrahydrochloride
2.1.2 InChI
InChI=1S/C8H20N4.4ClH/c1-2-10-5-6-12-8-7-11-4-3-9-1;;;;/h9-12H,1-8H2;4*1H
2.1.3 InChI Key
SBWLCGZEBQGYRP-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CNCCNCCNCCN1.Cl.Cl.Cl.Cl
2.2 Other Identifiers
2.2.1 UNII
51830Y7TIX
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 10045-25-7

2. Cyclen Tetrahydrochloride

3. Tetraaza-12-crown-4 Tetrahydrochloride

4. 1,4,7,10-tetraazacyclododecane, Tetrahydrochloride

5. Cyclen Tetrahydrochloride [mi]

6. 1,4,7,10-tetraazacyclododecane, Hydrochloride (1:4)

7. 1,4,7,10-tetrazacyclododecane;tetrahydrochloride

8. 1,4,7,10-tetraazacyclododecane Tetra, Hcl

9. 51830y7tix

10. Cyclen-4hcl

11. 1,4,7,10-tetraazacyclododecane,hydrochloride

12. Nsc-249332

13. Unii-51830y7tix

14. Cyclen Tetrahydrochloride, 98%

15. Dtxsid70143291

16. Bcp15868

17. Mfcd00068484

18. Akos015899824

19. 1,4,7,10-tetraazacyclododecane 4hcl

20. Nsc 249332

21. Ac-26288

22. As-18885

23. Db-027328

24. Am20070648

25. Ft-0676155

26. T1426

27. F17698

28. 1,4,7,10-tetraazacyclododecane Tetrahcl

29. 045t257

30. A847170

31. J-503961

32. Q27260886

33. 1,4,7,10-tetraazacyclododecane Tetrahydrochloride, >=97.0% (n)

2.4 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 318.1 g/mol
Molecular Formula C8H24Cl4N4
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass318.072557 g/mol
Monoisotopic Mass316.075508 g/mol
Topological Polar Surface Area48.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity65.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count5
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