CAS 55112-42-0

Chemistry, 3 End Use API, 4 Related Intermediates

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Also known as: 55112-42-0, 4-methylpiperazine-1-carbonyl chloride hydrochloride, 4-methyl-1-piperazinecarbonyl chloride hcl, 4-methylpiperazine-1-carbonyl chloride monohydrochloride, 1-piperazinecarbonyl chloride, 4-methyl-, monohydrochloride, 4-methylpiperazine-1-carbonyl chloride;hydrochloride

Molecular Formula

C₆H₁₂Cl₂N₂O

Molecular Weight

199.08 g/mol

InChI Key

WICNYNXYKZNNSN-UHFFFAOYSA-N

FDA UNII

7T2R5ALS8T

1 2D Structure

CAS 55112-42-0

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-methylpiperazine-1-carbonyl chloride;hydrochloride

2.1.2 InChI

InChI=1S/C6H11ClN2O.ClH/c1-8-2-4-9(5-3-8)6(7)10;/h2-5H2,1H3;1H

2.1.3 InChI Key

WICNYNXYKZNNSN-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN1CCN(CC1)C(=O)Cl.Cl

2.2 Other Identifiers

2.2.1 UNII

7T2R5ALS8T

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 55112-42-0

2. 4-methylpiperazine-1-carbonyl Chloride Hydrochloride

3. 4-methyl-1-piperazinecarbonyl Chloride Hcl

4. 4-methylpiperazine-1-carbonyl Chloride Monohydrochloride

5. 1-piperazinecarbonyl Chloride, 4-methyl-, Monohydrochloride

6. 4-methylpiperazine-1-carbonyl Chloride;hydrochloride

7. N-methylpiperazin-4-carbamoyl Chloride Hydrochloride

8. 4-methyl-1-piperazinecarbonyl Chloride, Hcl

9. 1-chlorocarbonyl-4-methylpiperazine Hydrochloride

10. Einecs 259-482-8

11. 7t2r5als8t

12. 4-methyl-1-piperazinecarbonylchloridehydrochloride

13. Schembl321914

14. Dtxsid80203633

15. Wicnynxykznnsn-uhfffaoysa-n

16. Bcp16973

17. Geo-01914

18. Mfcd01074875

19. Akos015897706

20. Ac-24406

21. Ps-10936

22. Ft-0640293

23. Ft-0658732

24. F16753

25. 4-methylpiperazine Carbonylchloride Hydrochloride

26. En300-1265364

27. 1-chlorocarbonyl-4-methyl Piperazine Hydrochloride

28. 1-chlorocarbonyl-4-methyl-piperazine Hydrochloride

29. 4-chlorocarbonyl-1-methyl-piperazine Hydrochloride

30. A830496

31. N-chlorocarbonyl-n'-methylpiperazine Hydrochloride

32. 4-methyl-l-piperazinecarbonyl Chloride Hydrochloride

33. W-200427

34. 4-methyl-1-piperazine Carbonyl Chloride Hydrochloride

35. 4-methyl-l-piperazine Carbonyl Chloride Hydrochloride

36. 4-methyl-piperazine-1-carbonyl Chloride Hydrochloride

37. 4-methylpiperazin-1-ylcarbonyl Chloride Hydrochloride

38. N-methylpiperazine-4-carbamoyl Chloride Hydrochloride

39. F0001-1447

40. N-methylpiperazin-4-carbamoylchloridehydrochloride

41. 1-piperazinecarbonyl Chloride, 4-methyl-, Hydrochloride (1:1)

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₆H₁₂Cl₂N₂O
Molecular Weight	199.08 g/mol
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	23.6
Heavy Atom Count	11
Formal Charge	0
Complexity	132
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	2

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Aptra Synthesis Private Limited, is a reliable and vertically integrated manufacturer of APIs and interme...

Aptra Synthesis Private Limited, is a reliable and vertically integrated manufacturer of APIs and intermediates, boasting state-of-the-art manufacturing facilities that adhere to GMP standards. We take great pride in producing top-notch intermediates through our fully backward-integrated process. Aptra Synthesis Private Limited (ASPL) stands as one of the rapidly emerging manufacturers of Active Pharmaceutical Ingredients (APIs), Pellets (Semi-finished Formulations), and Intermediates.

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Zeon Pharma Industries India Pvt ltd is an ISO & GMP certified manufacturer & exporter of Bulk drugs / Se...

Zeon Pharma Industries India Pvt ltd is an ISO & GMP certified manufacturer & exporter of Bulk drugs / Semi finish formulations & Intermediate and also has a GMP certified Manufacturing facility for Phytochemicals / Herbal extract and Enzymes through our associates.

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Established in the early 90’s SCL offers a wide range of Active Pharmaceutical Ingredients and Intermed...

Established in the early 90’s SCL offers a wide range of Active Pharmaceutical Ingredients and Intermediates to its customers worldwide. SCL’s products are exported to Europe, Japan, Russia, South and Central America, ASEAN, W. Asia, MENA regions. SCL’s manufacturing facilities have been built to comply with EU GMP and U.S. FDA norms, and the API facility has been successfully certified as EU GMP compliant five times by the European Authorities. Latest certification was carried out by German Health Authority.

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