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2D Structure
Also known as: Picolinaldehyde, 1121-60-4, Pyridine-2-carbaldehyde, Pyridine-2-carboxaldehyde, 2-formylpyridine, Picolinal
Molecular Formula
C6H5NO
Molecular Weight
107.11  g/mol
InChI Key
CSDSSGBPEUDDEE-UHFFFAOYSA-N
FDA UNII
KH86K8FHZ2

2-Pyridinecarboxaldehyde is a natural product found in Capparis spinosa with data available.
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
pyridine-2-carbaldehyde
2.1.2 InChI
InChI=1S/C6H5NO/c8-5-6-3-1-2-4-7-6/h1-5H
2.1.3 InChI Key
CSDSSGBPEUDDEE-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=NC(=C1)C=O
2.2 Other Identifiers
2.2.1 UNII
KH86K8FHZ2
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Picolinaldehyde

2. 1121-60-4

3. Pyridine-2-carbaldehyde

4. Pyridine-2-carboxaldehyde

5. 2-formylpyridine

6. Picolinal

7. Pyridine-2-aldehyde

8. 2-picolinaldehyde

9. 2-pyridaldehyde

10. O-nicotinaldehyde

11. Pyridinecarboxaldehyde

12. Picolinic Aldehyde

13. 2-picolinealdehyde

14. 2-pyridylaldehyde

15. 2-pyridylcarboxaldehyde

16. 26445-06-7

17. 2-pyridinecarbaldehyde

18. 2-pyridine Carboxaldehyde

19. 2-formyl-pyridine

20. 2-pyridinealdehyde

21. Mfcd00006290

22. Alpha-picolinaldehyde

23. 2-pyridylformaldehyde

24. .alpha.-picolinaldehyde

25. Nsc 8951

26. Kh86k8fhz2

27. Chebi:73012

28. Nsc-8951

29. Formylpyridine

30. Picolinealdehyde

31. Picolin Aldehyde

32. Carbonyl-pyridine

33. Picoline Aldehyde

34. Pyridine Aldehyde

35. 2-formyl Pyridine

36. Pyridinecarbaldehyde

37. Pyridincarboxaldehyde

38. 2-pyridine Aldehyde

39. Einecs 214-333-6

40. 2-pyridylcarbaldehyde

41. Pyridine-carboxaldehyde

42. 2-pyridinecarboaldehyde

43. 2-pyridinecarboxaldeyde

44. Pyridin-2-carbaldehyde

45. Pyridin-2-yl-methanone

46. Pyridine-2 Carbaldehyde

47. Pyridine-2-formaldehyde

48. Pyridine2-carboxaldehyde

49. 2-pyridyl Carboxaldehyde

50. 2-pyridyl-carboxaldehyde

51. (pyridin-2-yl)methanone

52. Ai3-33230

53. 2-pyridine-carboxaldehyde

54. Pyridine 2-carboxaldehyde

55. Unii-kh86k8fhz2

56. Ec 214-333-6

57. Schembl55278

58. Schembl730714

59. 2-pyridinecarboxaldehyde, 99%

60. Chembl274794

61. Pyridin-2-carboxaldehyde

62. Dtxsid1061522

63. 2-formylpyridine, Picolinaldehyde

64. Nsc8951

65. Picolinaldehyde;pyridine-2-aldehyde

66. Bcp21804

67. Bbl027574

68. Stl146657

69. 4,4'-bis(chlorosulfonyl)diphenylether

70. Akos000119317

71. Ab00680

72. Ac-5098

73. Cs-w007336

74. Ps-9301

75. Db-015971

76. Am20050672

77. Ns00005186

78. P0425

79. En300-18999

80. A20908

81. D77679

82. Q-101278

83. Q4596887

84. F2190-0594

85. Z104472152

86. Inchi=1/c6h5no/c8-5-6-3-1-2-4-7-6/h1-5

87. Picolinaldehyde; 2-pyridinecarbaldehyde; Pyridine-2-aldehyde

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 107.11 g/mol
Molecular Formula C6H5NO
XLogP30.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area30
Heavy Atom Count8
Formal Charge0
Complexity82.6
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1