AM20080016

Synopsis, Chemistry

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Also known as: 1069-31-4, 2,5-diaminopentanoic acid hydrochloride, Dl-ornithine monohydrochloride, H-dl-orn-oh.hcl, Dl-ornithine hcl, Ornithine, monohydrochloride

Molecular Formula

C₅H₁₃ClN₂O₂

Molecular Weight

168.62 g/mol

InChI Key

GGTYBZJRPHEQDG-UHFFFAOYSA-N

1 2D Structure

AM20080016

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2,5-diaminopentanoic acid;hydrochloride

2.1.2 InChI

InChI=1S/C5H12N2O2.ClH/c6-3-1-2-4(7)5(8)9;/h4H,1-3,6-7H2,(H,8,9);1H

2.1.3 InChI Key

GGTYBZJRPHEQDG-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C(CC(C(=O)O)N)CN.Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 1069-31-4

2. 2,5-diaminopentanoic Acid Hydrochloride

3. Dl-ornithine Monohydrochloride

4. H-dl-orn-oh.hcl

5. Dl-ornithine Hcl

6. Ornithine, Monohydrochloride

7. Dl-ornithine, Hydrochloride

8. Mfcd00065398

9. 2,5-diaminopentanoic Acid;hydrochloride

10. H-d-orn-oh Hcl

11. Ornithine, Hydrochloride (1:)

12. 22834-83-9

13. (+/-)-2,5-diaminopentanoic Acid Monohydrochloride

14. Ornithine Hcl

15. Nsc118360

16. Ornithine Dl-form Hcl

17. (2s)-2,5-diaminopentanoic Acid Hydrochloride

18. Mfcd00012917

19. Nsc-118360

20. Ornithine, Monohydrochloride, Dl-

21. Ornithine Dl-form Monohydrochloride

22. Einecs 213-956-0

23. Nsc 25163

24. Ai3-26557

25. Dl-ornithinexhydrochloride

26. Dl-ornithine Xhydrochloride

27. Dl-ornithine (hydrochloride)

28. Schembl534810

29. Sgcut00223

30. Wln: Z3yzvq &gh -l

31. Chembl1972294

32. Ornithine, Hydrochloride (1:1)

33. Dtxsid90920541

34. L-ornithine-13c5,15n2 Hcl

35. 1346617-00-2

36. Bcp13629

37. D(+)-2,5-diamino-pentanoic Acid

38. L(+)-2,5-diamino-pentanoic Acid

39. Nsc25163

40. To_000074

41. Ornithine Hydrochloride,(dl)

42. Ac1496

43. Nsc-25163

44. Nsc118361

45. Ornithine--hydrogen Chloride (1/1)

46. Akos008056531

47. Dl-ornithine Monohydrochloride, ~99%

48. Ccg-213889

49. Nsc-118361

50. (4-amino-1-carboxybutyl)azanium;chloride

51. 2,5-diaminovaleric Acid Monohydrochloride

52. As-12881

53. Sy005810

54. Sy007936

55. 2,5-bis(azanyl)pentanoic Acid Hydrochloride

56. 2,5-diaminopentanoic Acid Monohydrochloride

57. Db-040717

58. Db-048118

59. Am20080016

60. Cs-0136494

61. Ft-0625497

62. Ft-0625590

63. Ft-0627979

64. Ft-0673307

65. Ft-0695773

66. O0063

67. Dl-ornithine Monohydrochloride, >=99.0% (at)

68. A801537

69. A821021

70. J-001677

71. Z262221498

2.3 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₅H₁₃ClN₂O₂
Molecular Weight	168.62 g/mol
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	168.0665554 g/mol
Monoisotopic Mass	168.0665554 g/mol
Topological Polar Surface Area	89.3 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	95
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2