CAS-619-67-0 - Uses, DMF, Dossier, Manufacturer, Supplier, Licensing, Distributer, Prices, News, GMP

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Also known as: 619-67-0, 4-hydrazinylbenzoic acid, P-hydrazinobenzoic acid, Benzoic acid, 4-hydrazino-, P-carboxyphenylhydrazine, 4-carboxyphenylhydrazine

Molecular Formula

C₇H₈N₂O₂

Molecular Weight

152.15 g/mol

InChI Key

PCNFLKVWBDNNOW-UHFFFAOYSA-N

FDA UNII

B1R368JE7O

4-hydrazinobenzoic acid is a natural product found in Agaricus bisporus with data available.

1 2D Structure

CAS 619-67-0

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-hydrazinylbenzoic acid

2.1.2 InChI

InChI=1S/C7H8N2O2/c8-9-6-3-1-5(2-4-6)7(10)11/h1-4,9H,8H2,(H,10,11)

2.1.3 InChI Key

PCNFLKVWBDNNOW-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=CC=C1C(=O)O)NN

2.2 Other Identifiers

2.2.1 UNII

B1R368JE7O

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 4-hydrazinobenzoic Acid Monohydrochloride

2.3.2 Depositor-Supplied Synonyms

1. 619-67-0

2. 4-hydrazinylbenzoic Acid

3. P-hydrazinobenzoic Acid

4. Benzoic Acid, 4-hydrazino-

5. P-carboxyphenylhydrazine

6. 4-carboxyphenylhydrazine

7. (4-carboxyphenyl)hydrazine

8. Benzoic Acid, P-hydrazino-

9. 4-hydrazino Benzoic Acid

10. Mfcd00007581

11. Benzoic Acid, 4-hydrazinyl-

12. B1r368je7o

13. Nsc-3813

14. Ccris 7911

15. Nsc 3813

16. Einecs 210-609-5

17. Brn 0387378

18. Unii-b1r368je7o

19. Ai3-21063

20. P-hydrazino Benzoic Acid

21. Dsstox_cid_708

22. Schembl7034

23. Dsstox_rid_75749

24. Dsstox_gsid_20708

25. Oprea1_377686

26. 4-15-00-01372 (beilstein Handbook Reference)

27. 4-hydrazinobenzoic Acid, 97%

28. Chembl3189010

29. Dtxsid3020708

30. (p-carboxyphenyl)hydrazine

31. Nsc3813

32. 4-hydrazinobenzoicacidhydrochloride

33. Hms1787j10

34. Zinc157417

35. Act01005

36. Bcp27403

37. Tox21_200198

38. Bbl008190

39. Stk391437

40. Akos000119274

41. Ac-1781

42. Cs-w018098

43. Ps-5959

44. Sb75849

45. Ncgc00248560-01

46. Ncgc00248560-02

47. Ncgc00257752-01

48. Cas-619-67-0

49. Sy018304

50. Db-054034

51. A5051

52. Bb 0220537

53. Deferasirox Impurity F [ep Impurity]

54. Ft-0618608

55. H0800

56. A15703

57. Q-200475

58. Q27274260

59. F0865-0011

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₇H₈N₂O₂
Molecular Weight	152.15 g/mol
XLogP3	-0.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	152.058577502 g/mol
Monoisotopic Mass	152.058577502 g/mol
Topological Polar Surface Area	75.4 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	141
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