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2D Structure
Also known as: 593-84-0, Guanidinium thiocyanate, Guanidinium rhodanide, Guanidine;thiocyanic acid, Guanidinium isothiocyanate, Thiocyanic acid, compd. with guanidine (1:1)
Molecular Formula
C2H6N4S
Molecular Weight
118.16  g/mol
InChI Key
ZJYYHGLJYGJLLN-UHFFFAOYSA-N
FDA UNII
GCA2EU297U

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
guanidine;thiocyanic acid
2.1.2 InChI
InChI=1S/CH5N3.CHNS/c2-1(3)4;2-1-3/h(H5,2,3,4);3H
2.1.3 InChI Key
ZJYYHGLJYGJLLN-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C(#N)S.C(=N)(N)N
2.2 Other Identifiers
2.2.1 UNII
GCA2EU297U
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Guanidinium Thiocyanate

2. Guscn

2.3.2 Depositor-Supplied Synonyms

1. 593-84-0

2. Guanidinium Thiocyanate

3. Guanidinium Rhodanide

4. Guanidine;thiocyanic Acid

5. Guanidinium Isothiocyanate

6. Thiocyanic Acid, Compd. With Guanidine (1:1)

7. Mfcd00013027

8. Gca2eu297u

9. Nsc-2119

10. Gtc

11. Usaf Ek-705

12. Guanidinethiocyanate

13. Nsc 2119

14. Einecs 209-812-1

15. Buffer Avl

16. Ai3-18430

17. Unii-gca2eu297u

18. Schembl28942

19. Guanidine Thiocyanate Solu-tion

20. Guanidine Thiocyanate, Ultrapure

21. Dtxsid6060478

22. Isothiocyanic Acid, Compd. With Guanidine (1:1) (van)

23. Nsc2119

24. Guanidine Thiocyanate, >=99.5%

25. Hy-d0841

26. Akos015961014

27. Guanidine Thiocyanate, >=97.0% (at)

28. Bp-13066

29. Ls-12942

30. Sy003172

31. Guanidine Thiocyanate, >=97% (titration)

32. Cs-0014812

33. G0230

34. G0360

35. Guanidine Thiocyanate, Molecular Biology Grade

36. G-8100

37. G-8102

38. M01833

39. Isothiocyanic Acid, Compd. With Guanidine (1:1)

40. Q904487

41. Guanidine Thiocyanate, For Molecular Biology, >=99%

42. Guanidine Thiocyanate, Vetec(tm) Reagent Grade, >=97%

43. Guanidine Thiocyanate, Bioreagent, For Molecular Biology, >=99%

44. Guanidine Thiocyanate, Bioultra, For Molecular Biology, >=99.0% (at)

45. Guanidine Thiocyanate Solution, Bioultra, For Molecular Biology, ~4 M In H2o

46. Guanidine Thiocyanate Solution, Bioultra, For Molecular Biology, ~6 M In H2o

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 118.16 g/mol
Molecular Formula C2H6N4S
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass118.03131738 g/mol
Monoisotopic Mass118.03131738 g/mol
Topological Polar Surface Area101 Ų
Heavy Atom Count7
Formal Charge0
Complexity57.6
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Disinfectants

Substances used on inanimate objects that destroy harmful microorganisms or inhibit their activity. Disinfectants are classed as complete, destroying SPORES as well as vegetative forms of microorganisms, or incomplete, destroying only vegetative forms of the organisms. They are distinguished from ANTISEPTICS, which are local anti-infective agents used on humans and other animals. (From Hawley's Condensed Chemical Dictionary, 11th ed) (See all compounds classified as Disinfectants.)