1,1,3,3-Tetramethylguanidine

Synopsis, Chemistry

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Also known as: 80-70-6, Tetramethylguanidine, N,n,n',n'-tetramethylguanidine, Guanidine, n,n,n',n'-tetramethyl-, Tetramethyl guanidine, Guanidine, 1,1,3,3-tetramethyl-

Molecular Formula

C₅H₁₃N₃

Molecular Weight

115.18 g/mol

InChI Key

KYVBNYUBXIEUFW-UHFFFAOYSA-N

FDA UNII

VEZ101E7ZU

1 2D Structure

1,1,3,3-Tetramethylguanidine

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1,1,3,3-tetramethylguanidine

2.1.2 InChI

InChI=1S/C5H13N3/c1-7(2)5(6)8(3)4/h6H,1-4H3

2.1.3 InChI Key

KYVBNYUBXIEUFW-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CN(C)C(=N)N(C)C

2.2 Other Identifiers

2.2.1 UNII

VEZ101E7ZU

2.3 Synonyms

2.3.1 MeSH Synonyms

1. N,n,n',n'-tetramethylguanidine

2.3.2 Depositor-Supplied Synonyms

1. 80-70-6

2. Tetramethylguanidine

3. N,n,n',n'-tetramethylguanidine

4. Guanidine, N,n,n',n'-tetramethyl-

5. Tetramethyl Guanidine

6. Guanidine, 1,1,3,3-tetramethyl-

7. Vez101e7zu

8. 1,1,3,3-tetramethyl Guanidine

9. 1,1,3,3-tetramethyl-guanidine

10. N,n,n',n'-tetramethyl-guanidine

11. Nsc-148309

12. Mfcd00008323

13. Unii-vez101e7zu

14. Ccris 6689

15. Tetramethyguanidine

16. Tetramethlguanidine

17. Einecs 201-302-7

18. Tetramethyl-guanidine

19. Nsc 148309

20. Ai3-51030

21. N,n-1,1,3,3-tetramethylguanidine

22. (me2n)2c=nh

23. 1,3,3-tetramethylguanidine

24. N,n,n,n-tetramethylguanidine

25. Schembl35686

26. N,n',n'-tetramethylguanidine

27. Guanidine,1,3,3-tetramethyl-

28. Dtxsid2058835

29. 1, 1,3,3-tetramethylguanidine

30. 1,1,3,3 Tetramethyl Guanidine

31. 1,1,3,3,-tetramethylguanidine

32. 1,1,3,3-tetra-methylguanidine

33. N,n,n',n'-tetramethyl Guanidine

34. Guanidine,n,n',n'-tetramethyl-

35. Bcp25863

36. Str04857

37. Bbl027708

38. Nsc148309

39. Stl146626

40. Akos005169836

41. Zinc100009237

42. 1,1,3,3-tetramethylguanidine, 99%

43. 1,1,3,3-tetramethylguanidine [mi]

44. Cs-0015318

45. Ft-0606006

46. T0148

47. 80t706

48. Q4545643

49. W-104226

50. F0001-2088

51. N,n,n',n'-tetramethylguanidine, Lonza Quality, >=99.0% (gc)

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₅H₁₃N₃
Molecular Weight	115.18 g/mol
XLogP3	0.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	115.110947427 g/mol
Monoisotopic Mass	115.110947427 g/mol
Topological Polar Surface Area	30.3 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	75.7
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	1