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CAS 106261-64-7 manufacturers and suppliers on PharmaCompass

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CAS 106261-64-7
Also known as: 106261-64-7, 4-((4-methylpiperazin-1-yl)methyl)benzoyl chloride dihydrochloride, 4-[(4-methylpiperazin-1-yl)methyl]benzoyl chloride;dihydrochloride, 4-[(4-methylpiperazin-1-yl)methyl]benzoyl chloride dihydrochloride, Mfcd11519983, 4-((4-methylpiperazin-1-yl)methyl)benzoyl chloride 2hcl
Molecular Formula
C13H19Cl3N2O
Molecular Weight
325.7  g/mol
InChI Key
DDKLQZDSVJKYLJ-UHFFFAOYSA-N

1 2D Structure

CAS 106261-64-7

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-[(4-methylpiperazin-1-yl)methyl]benzoyl chloride;dihydrochloride
2.1.2 InChI
InChI=1S/C13H17ClN2O.2ClH/c1-15-6-8-16(9-7-15)10-11-2-4-12(5-3-11)13(14)17;;/h2-5H,6-10H2,1H3;2*1H
2.1.3 InChI Key
DDKLQZDSVJKYLJ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CN1CCN(CC1)CC2=CC=C(C=C2)C(=O)Cl.Cl.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 106261-64-7

2. 4-((4-methylpiperazin-1-yl)methyl)benzoyl Chloride Dihydrochloride

3. 4-[(4-methylpiperazin-1-yl)methyl]benzoyl Chloride;dihydrochloride

4. 4-[(4-methylpiperazin-1-yl)methyl]benzoyl Chloride Dihydrochloride

5. Mfcd11519983

6. 4-((4-methylpiperazin-1-yl)methyl)benzoyl Chloride 2hcl

7. Benzoyl Chloride, 4-[(4-methyl-1-piperazinyl)methyl]-, Dihydrochloride

8. 4-(4-methylpiperazin-1-ylmethyl)benzoyl Chloride Dihydrochloride

9. 4-[(4-methyl-1-piperazinyl)methyl]benzoyl Chloride Dihydrochloride

10. Schembl529195

11. Dtxsid10603844

12. Amy22082

13. 4-[(4-methylpiperazin-1-yl)methyl]benzoyl Chloride,dihydrochloride

14. 4-[(4-methylpiperazin-1-yl)methyl]benzoyl Chloride--hydrogen Chloride (1/2)

15. Akos015909677

16. Ac-23930

17. As-39950

18. Sy245383

19. Ft-0658811

20. 261m647

21. A801429

22. A851421

23. A1-03413

24. 4-(4-methylpiperazinylmethyl)benzoyl Chloride 2hcl

25. 4-(4-methylpiperazinylmethyl)benzoyl-chloride Dihydrochloride

26. 4-(4-methylpiperzin-1-ylmethyl)benzoyl Chloride Dihydrochloride

27. 4-(4-methylpiperazin-1-yl-methyl)benzoyl Chloride Dihydrochloride

28. 4-[(4-methyl-1-piperazinyl)methyl]benzoyl Chloride, Dihydrochloride

2.3 Create Date
2007-12-05
3 Chemical and Physical Properties
Molecular Weight 325.7 g/mol
Molecular Formula C13H19Cl3N2O
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass324.056296 g/mol
Monoisotopic Mass324.056296 g/mol
Topological Polar Surface Area23.6 Ų
Heavy Atom Count19
Formal Charge0
Complexity256
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3
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106261-64-7
Suanfarma founded in 1993, is a B2B life science partner committed to health & innovation by developing, ...
Suanfarma founded in 1993, is a B2B life science partner committed to health & innovation by developing, manufacturing, & distributing high-quality APIs for the pharmaceutical industry innovatively & sustainably. Backed by a robust global network of 12 strategically located local offices, we cater to the needs of over 400 active customers in 70+ countries. At Suanfarma we offer our CDMO capacity for fermentation & chemical synthesis projects, offering a One Stop Shop service with a solid track record, & which allows us to achieve success in the development, scaling, manufacturing, & commercialization of an API, either innovative or generic.
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