CAS 873-83-6

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3 Related Intermediates

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Also known as: 873-83-6, 4-amino-2,6-dihydroxypyrimidine, 6-aminopyrimidine-2,4(1h,3h)-dione, 6-aminopyrimidine-2,4-diol, 4-aminouracil, 6-amino-2,4-pyrimidinediol

Molecular Formula

C₄H₅N₃O₂

Molecular Weight

127.10 g/mol

InChI Key

LNDZXOWGUAIUBG-UHFFFAOYSA-N

1 2D Structure

CAS 873-83-6

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

6-amino-1H-pyrimidine-2,4-dione

2.1.2 InChI

InChI=1S/C4H5N3O2/c5-2-1-3(8)7-4(9)6-2/h1H,(H4,5,6,7,8,9)

2.1.3 InChI Key

LNDZXOWGUAIUBG-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=C(NC(=O)NC1=O)N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 873-83-6

2. 4-amino-2,6-dihydroxypyrimidine

3. 6-aminopyrimidine-2,4(1h,3h)-dione

4. 6-aminopyrimidine-2,4-diol

5. 4-aminouracil

6. 6-amino-2,4-pyrimidinediol

7. 6-amino-1h-pyrimidine-2,4-dione

8. 2,4(1h,3h)-pyrimidinedione, 6-amino-

9. 6-amino-2,4-dihydroxypyrimidine

10. Cytosine, 6-hydroxy-

11. Uracil, 6-amino-

12. 4-amino-2,6-pyrimidinediol

13. 4-amino-2,6-dioxypyrimidine

14. 143505-00-4

15. 4-amino-2,6-dihydroxylpyrimidine

16. 143519-01-1

17. Nsc 7367

18. Nsc 15919

19. 2,4-pyrimidinediol, 6-amino- (9ci)

20. 4(3h)-pyrimidinone, 6-amino-2-hydroxy- (9ci)

21. 2,4-pyrimidinediol, 6-amino-

22. Mfcd00006071

23. 2(1h)-pyrimidinone, 6-amino-4-hydroxy- (9ci)

24. 4(1h)-pyrimidinone, 6-amino-2-hydroxy- (9ci)

25. 6-amino-1,2,3,4-tetrahydropyrimidine-2,4-dione

26. 143519-00-0

27. 143519-02-2

28. 6-amino-2-hydroxypyrimidin-4(3h)-one

29. Wln: T6mvmvj Fz

30. 2,3h)-pyrimidinedione, 6-amino-

31. Einecs 212-854-3

32. Uracil, 6-amino- (van)

33. Ai3-17659

34. 6-amino-uracil

35. 6-hydroxycytosine

36. Group1_pyrimidines

37. 6ua

38. 4(6)-aminouracil

39. 6-aminouracil, 97%

40. Schembl94409

41. Chembl86636

42. 6-amino-pyrimidine-2,4-diol

43. Dtxsid5061241

44. Nsc7367

45. Chebi:184013

46. 4-amino-2,6-dihydroxy Pyrimidine

47. 6-amino-2,4-dihydroxy-pyrimidine

48. Zinc967278

49. Amy11023

50. Cs-m2443

51. Nsc-7367

52. Nsc15919

53. Str01392

54. 2,4-pyrimidinediol,6-amino-(9ci)

55. Bbl028134

56. Nsc-15919

57. Stk328164

58. Akos000119613

59. Akos002268783

60. Ccg-358234

61. Ps-4527

62. Sb39247

63. Sb55545

64. Ac-22764

65. Sy006432

66. 6-amino-2,4(1h,3h)-pyrimidinedione #

67. 6-aminopyrimidine-2,4-diol;6-aminouracil

68. Db-056997

69. A0658

70. Ft-0617455

71. Ft-0660294

72. A-7400

73. Ac-907/25004303

74. J-640157

75. F3318-0152

76. Z314598776

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₄H₅N₃O₂
Molecular Weight	127.10 g/mol
XLogP3	-1.6
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	127.038176411 g/mol
Monoisotopic Mass	127.038176411 g/mol
Topological Polar Surface Area	84.2 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	196
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