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CAS 10017-11-5
PharmaCompass
CAS 10017-11-5
Also known as: 10017-11-5, 3-aminopropene hydrochloride, Poly(allylamine hydrochloride), Allylamine, hydrochloride, Allylammonium chloride, 2-propen-1-amine, hydrochloride
Molecular Formula
C3H8ClN
Molecular Weight
93.554  g/mol
InChI Key
MLGWTHRHHANFCC-UHFFFAOYSA-N
FDA UNII
R2H25ILF98

1 2D Structure

CAS 10017-11-5

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
prop-2-en-1-amine;hydrochloride
2.1.2 InChI
InChI=1S/C3H7N.ClH/c1-2-3-4;/h2H,1,3-4H2;1H
2.1.3 InChI Key
MLGWTHRHHANFCC-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C=CCN.Cl
2.2 Other Identifiers
2.2.1 UNII
R2H25ILF98
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 10017-11-5

2. 3-aminopropene Hydrochloride

3. Poly(allylamine Hydrochloride)

4. Allylamine, Hydrochloride

5. Allylammonium Chloride

6. 2-propen-1-amine, Hydrochloride

7. 71550-12-4

8. 2-propen-1-amine Hydrochloride

9. Allylaminehydrochloride

10. Prop-2-en-1-amine Hydrochloride

11. Unii-r2h25ilf98

12. Allylamine Hcl

13. Allylamine, Hydrochloride, Homopolymer

14. Acmc-1bveo

15. C3h7n.hcl

16. 2-propen-1-amine, Hydrochloride, Homopolymer

17. Monoallylamine Hydrochloride

18. Mono-allylamine Hydrochloride

19. Allylamine Hydrochloride, 98%

20. 2-propen-1-amine, Hydrochloride (1:1), Homopolymer

21. Ac1q38r5

22. R2h25ilf98

23. Allylamine Hydrochloride (1:1)

24. Ctk3j2830

25. Prop-2-en-1-amine Hcl

26. Dtxsid60872280

27. Mlgwthrhhanfcc-uhfffaoysa-n

28. Molport-003-929-192

29. 30551-89-4 (parent)

30. Ac1l3347

31. Ebd34819

32. Ks-00000w6n

33. 7063af

34. Anw-14173

35. Mfcd00054329

36. Akos015847154

37. Rtr-000055

38. Tra0127983

39. 2-propen-1-amine, Hydrochloride (1:1)

40. Ak486967

41. An-37558

42. Kb-74580

43. Ls-16408

44. Sc-20038

45. 2-propen-1-amine Hydrochloride, Aldrichcpr

46. Ab0078225

47. Db-058318

48. Tr-000055

49. A0226

50. Ft-0622039

51. Ft-0724079

52. I14-16422

53. 204719-79-9

2.4 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 93.554 g/mol
Molecular Formula C3H8ClN
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass93.035 g/mol
Monoisotopic Mass93.035 g/mol
Topological Polar Surface Area26 A^2
Heavy Atom Count5
Formal Charge0
Complexity17.2
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
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