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CAS 5398-36-7

Chemistry, 2 End Use API, 11 Related Intermediates

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Also known as: 5398-36-7, Ethyl 2-amino-1,3-thiazole-4-carboxylate, Ethyl 2-amino-4-thiazolecarboxylate, 2-amino-thiazole-4-carboxylic acid ethyl ester, 4-thiazolecarboxylic acid, 2-amino-, ethyl ester, Mfcd00619079

Molecular Formula

C₆H₈N₂O₂S

Molecular Weight

172.21 g/mol

InChI Key

XHFUVBWCMLLKOZ-UHFFFAOYSA-N

1 2D Structure

CAS 5398-36-7

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

ethyl 2-amino-1,3-thiazole-4-carboxylate

2.1.2 InChI

InChI=1S/C6H8N2O2S/c1-2-10-5(9)4-3-11-6(7)8-4/h3H,2H2,1H3,(H2,7,8)

2.1.3 InChI Key

XHFUVBWCMLLKOZ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC(=O)C1=CSC(=N1)N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 5398-36-7

2. Ethyl 2-amino-1,3-thiazole-4-carboxylate

3. Ethyl 2-amino-4-thiazolecarboxylate

4. 2-amino-thiazole-4-carboxylic Acid Ethyl Ester

5. 4-thiazolecarboxylic Acid, 2-amino-, Ethyl Ester

6. Mfcd00619079

7. Ethyl 2-amino-4-thiazoleformate

8. 2-amino-4-ethoxycarbonylthiazole

9. 2-aminothiazole-4-carboxylic Acid Ethyl Ester

10. Nsc4464

11. Ethyl-2-aminothiazole-4-carboxylate

12. Ethyl-2-amino-1,3-thiazole-4-carboxylate

13. 2-aminothiazole-4-ethyl Formate

14. Ethyl-2-aminothiazole-4-carboxylic Acid

15. Nsc 4464

16. Ethyl-2-amino-thiazole-4-carboxylate

17. Nsc 43547

18. Ai3-18592

19. Timtec1_000957

20. Oprea1_347195

21. Oprea1_396207

22. Schembl220846

23. 2-amino-4-thiazolecarboxylic Acid Ethyl Ester

24. Chembl1620353

25. Dtxsid60202285

26. Ethyl 2-aminothiazole-4carboxilate

27. Hms1536l11

28. Ethyl 2-aminothiazol-4-carboxylate

29. Act02337

30. Albb-005840

31. Cfa94230

32. Ethyl-2-amino-4-thiazolecarboxylate

33. Nsc-4464

34. Nsc43547

35. Bbl007566

36. Geo-01316

37. Nsc-43547

38. Stk364430

39. Stl039046

40. Zinc18210877

41. Ethyl 2- Aminothiazole-4-carboxylate

42. Akos000122297

43. Akos005145107

44. Akos015995569

45. Ab06547

46. Ac-1620

47. Cs-w009022

48. Sdccgmls-0065431.p001

49. Sdccgmls-0065431.p002

50. 2-amino-4-ethoxycarbonyl-1,3-thiazole

51. Ncgc00174941-01

52. Ac-28659

53. Sy003333

54. 2-amino-4-(ethoxycarbonyl)-1,3-thiazole

55. Ethyl 2-aminothiazole-4-carboxylate, 96%

56. Db-012649

57. Am20100328

58. Bb 0240308

59. E1215

60. Ft-0625914

61. Ab00375627-06

62. 1x-0716

63. Q-102474

64. Brd-k01651344-001-01-7

65. Z48847558

66. Ethyl 2-imino-2,3-dihydro-1,3-thiazole-4-carboxylate

67. F0060-0149

68. 2-amino-1,3-thiazole-4-carboxylic Acid Ethyl Ester

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₆H₈N₂O₂S
Molecular Weight	172.21 g/mol
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	172.03064868 g/mol
Monoisotopic Mass	172.03064868 g/mol
Topological Polar Surface Area	93.4 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	154
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

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CAS Number

121-05-1

End Use API

Acotiamide

About the Company

MENADIONA is an independent privately-owned company, founded in 1970. Ever since, the company has been in...

MENADIONA is an independent privately-owned company, founded in 1970. Ever since, the company has been involved in manufacturing active ingredients (APIs) and key intermediates for the Pharmaceutical, Veterinary, Plant Health and Nutraceutical industries. In addition, Aziridine and its derivatives is one of the most outstanding business units for MENADIONA. Besides, we offer custom and contract manufacturing services through our Fine Chemical Division. With a highly qualified team and two manufacturing plants in Spain, MENADIONA is characterized by its strong worldwide export volume, which accounts for more than 80% of its sales.

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