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Valsynthese, part of the SSE Group, is a CDMO focused on highly energetic and highly hazardous chemistry.

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CHEMISTRY
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Chemistry

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Also known as: 2066-89-9, Pasiniazide, Pasiniazid [inn:dcf], Isoniazid 4-aminosalicylate, Paraniazide, Isonicotinohydrazide 4-amino-2-hydroxybenzoate

Molecular Formula

C₁₃H₁₄N₄O₄

Molecular Weight

290.27 g/mol

InChI Key

RKPHTRVPGYGVQD-UHFFFAOYSA-N

FDA UNII

83J17CN0MN

1 2D Structure

Pasiniazid

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-amino-2-hydroxybenzoic acid;pyridine-4-carbohydrazide

2.1.2 InChI

InChI=1S/C7H7NO3.C6H7N3O/c8-4-1-2-5(7(10)11)6(9)3-4;7-9-6(10)5-1-3-8-4-2-5/h1-3,9H,8H2,(H,10,11);1-4H,7H2,(H,9,10)

2.1.3 InChI Key

RKPHTRVPGYGVQD-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=C(C=C1N)O)C(=O)O.C1=CN=CC=C1C(=O)NN

2.2 Other Identifiers

2.2.1 UNII

83J17CN0MN

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Fintosid

2. Isoniazide 4-aminosalicylate

3. Pasiniazide

2.3.2 Depositor-Supplied Synonyms

1. 2066-89-9

2. Pasiniazide

3. Pasiniazid [inn:dcf]

4. Isoniazid 4-aminosalicylate

5. Paraniazide

6. Isonicotinohydrazide 4-amino-2-hydroxybenzoate

7. Rd 328

8. Aminosalicylic Acid Mixture With Isoniazid

9. 83j17cn0mn

10. Isonicotinic Acid Hydrazide Compound With 4-amino-salicylic Acid

11. Nsc-758447

12. Paraniazide;pasiniazide;isonicotinic Acid Hydrazide P-aminosalicylate

13. Isonicotinic Acid Hydrazide P-aminosalicylate

14. 4-amino-2-hydroxybenzoic Acid;pyridine-4-carbohydrazide

15. Pasiniazida

16. Pasiniazidum

17. Pasiniazide [inn-french]

18. Pasiniazidum [inn-latin]

19. Pasiniazida [inn-spanish]

20. Unii-83j17cn0mn

21. Pasiniazid,(s)

22. Einecs 218-183-2

23. Dipasic

24. Fintozid

25. Nidrapas

26. Pascidaber

27. Pashain

28. Pas-hidracida

29. Parasal Inh

30. Spectrum_001721

31. Isoniazid Mixture With Aminosalicylic Acid

32. Pasiniazid [inn]

33. Spectrum2_001936

34. Spectrum3_000775

35. Spectrum4_001203

36. Spectrum5_001203

37. Pasiniazid [who-dd]

38. Bspbio_002450

39. Kbiogr_001606

40. Kbioss_002201

41. Divk1c_000327

42. Schembl865578

43. Spectrum1503381

44. Isonicotinic Acid Hydrazide, Mono(4-aminosalicylate)

45. Spbio_001971

46. Pasiniazid, Analytical Standard

47. Gewo-399

48. Chembl1496806

49. Hms501a09

50. Kbio1_000327

51. Kbio2_002201

52. Kbio2_004769

53. Kbio2_007337

54. Kbio3_001670

55. 4-amino-2-hydroxy-benzoic Acid; Pyridine-4-carbohydrazide

56. Dtxsid50174700

57. Isoniazid & P-aminosalicylic Acid

58. Ninds_000327

59. Hms1922c06

60. Pharmakon1600-01503381

61. Caa06689

62. Hy-b1048

63. Isoniazid P-amino-salicylate

64. 4-pyridinecarboxylic Acid, Hydrazide, Mono(4-amino-2-hydroxybenzoate)

65. Ccg-39463

66. Nsc758447

67. Rd-328

68. S4404

69. Akos026749897

70. Cs-4569

71. Nsc 758447

72. Idi1_000327

73. Isoniazid 4-aminosalicylate [mi]

74. Ncgc00021150-01

75. Ncgc00021150-02

76. Ncgc00021150-03

77. Ncgc00021150-04

78. Ncgc00024460-02

79. Ncgc00024460-03

80. As-56163

81. Sbi-0051819.p002

82. Isonicotinohydrazide4-amino-2-hydroxybenzoate

83. Sw199569-2

84. Isonicotinic Acid Hydrazide P-*aminosalicylate

85. D70306

86. P-aminosalicylic Acid Isonicotinyl Hydrazide

87. Sr-01000000138

88. J-013511

89. Sr-01000000138-2

90. Q27269437

91. 4-amino-2-hydroxybenzoic Acid,pyridine-4-carbohydrazide

92. 4-pyridinecarboxylic Acid Hydrazide & 4-aminosalicylic Acid

93. Salicylic Acid, 4-amino-, Compd. With Isonicotinic Acid Hydrazide

94. 4-pyridinecarboxylic Acid, Hydrazide, Compd. With 4-amino-2-hydroxybenzoate (1:1)

95. Salicylic Acid, 4-amino-, Compd. With Isonicotinic Acid Hydrazide (1:1)

96. Benzoic Acid, 4-amino-2-hydroxy-, Compd. With 4-pyridinecarboxylic Acid Hydrazide (1:1)

2.4 Create Date

2005-06-29

3 Chemical and Physical Properties

Molecular Formula	C₁₃H₁₄N₄O₄
Molecular Weight	290.27 g/mol
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	290.10150494 g/mol
Monoisotopic Mass	290.10150494 g/mol
Topological Polar Surface Area	152 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	280
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	2