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Also known as: 127946-77-4, 1-aminocyclopropanecarbonitrile hydrochloride, 1-aminocyclopropanecarbonitrile hcl, 1-aminocyclopropane-1-carbonitrile hydrochloride, 1-amino-1-cyclopropanecarbonitrile, hcl, 1-amino-1-cyanocyclopropane hydrochloride
Molecular Formula
C4H7ClN2
Molecular Weight
118.56  g/mol
InChI Key
PCEIEQLJYDMRFZ-UHFFFAOYSA-N

CAS 127946-77-4
1 2D Structure

CAS 127946-77-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-aminocyclopropane-1-carbonitrile;hydrochloride
2.1.2 InChI
InChI=1S/C4H6N2.ClH/c5-3-4(6)1-2-4;/h1-2,6H2;1H
2.1.3 InChI Key
PCEIEQLJYDMRFZ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC1(C#N)N.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 127946-77-4

2. 1-aminocyclopropanecarbonitrile Hydrochloride

3. 1-aminocyclopropanecarbonitrile Hcl

4. 1-aminocyclopropane-1-carbonitrile Hydrochloride

5. 1-amino-1-cyclopropanecarbonitrile, Hcl

6. 1-amino-1-cyanocyclopropane Hydrochloride

7. 1-aminocyclopropane-1-carbonitrile;hydrochloride

8. Cyclopropanecarbonitrile, 1-amino-, Monohydrochloride

9. Mfcd04114063

10. 1-amino-1-cyclopropanecarbonitrile Hcl

11. 1-aminocyclopropanecarbonitrile Hydrochloride (1:1)

12. 1-cyanocyclopropanaminium Chloride

13. 1-amino-cyclopropyl Cyanic Hydrochloride

14. 1-amino-cyclopropanecarbonitrile Hydrochloride

15. Ec 629-718-8

16. 1-aminocyclopropionitrile Hcl

17. Schembl345144

18. Dtxsid20561926

19. 1-aminocyclopropanecarbonitrile-hcl

20. Act02795

21. Cs-d0921

22. 1-cyanocyclopropylamine Hydrochloride

23. Ac-863

24. Akos005145948

25. 1-aminocyclopropane-1-carbonitrile Hcl

26. Gs-3586

27. Pb48330

28. 1-aminocyclopropanecarbonitrile Hcl Salt

29. 1-aminocyclopropyl Cyanide Hydrochloride

30. Sy015717

31. Db-011668

32. Am20080205

33. Ft-0649314

34. 1-aminocyclopropane-carbonitrile Hydrochloride

35. En300-78342

36. 1-amino-1-cyclopropanecarbonitrilehydrochloride

37. A25580

38. 1-amino-1-cyclopropane Carbonitrile Hydrochloride

39. 1-amino-1-cyclopropane-carbonitrile Hydrochloride

40. 946a774

41. J-504202

42. 1-amino-1-cyclopropanecarbonitrile Hydrochloride, 97%

43. Cyclopropanecarbonitrile, 1-amino-, Hydrochloride (1:1)

44. Z1741972043

2.3 Create Date
2007-02-09
3 Chemical and Physical Properties
Molecular Weight 118.56 g/mol
Molecular Formula C4H7ClN2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass118.0297759 g/mol
Monoisotopic Mass118.0297759 g/mol
Topological Polar Surface Area49.8 Ų
Heavy Atom Count7
Formal Charge0
Complexity104
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

BUILDING BLOCK

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