CAS 32955-21-8

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16 Related Intermediates

Chemistry

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Also known as: 32955-21-8, Ethyl 2-amino-1,3-thiazole-5-carboxylate, Ethyl 2-amino-thiazole-5-carboxylate, 2-aminothiazole-5-carboxylic acid ethyl ester, Ethyl2-aminothiazole-5-carboxylate, 2-amino-thiazole-5-carboxylic acid ethyl ester

Molecular Formula

C₆H₈N₂O₂S

Molecular Weight

172.21 g/mol

InChI Key

VNZXERIGKZNEKB-UHFFFAOYSA-N

1 2D Structure

CAS 32955-21-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

ethyl 2-amino-1,3-thiazole-5-carboxylate

2.1.2 InChI

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

2.1.3 InChI Key

VNZXERIGKZNEKB-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC(=O)C1=CN=C(S1)N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 32955-21-8

2. Ethyl 2-amino-1,3-thiazole-5-carboxylate

3. Ethyl 2-amino-thiazole-5-carboxylate

4. 2-aminothiazole-5-carboxylic Acid Ethyl Ester

5. Ethyl2-aminothiazole-5-carboxylate

6. 2-amino-thiazole-5-carboxylic Acid Ethyl Ester

7. Mfcd00602139

8. 5-thiazolecarboxylic Acid, 2-amino-, Ethyl Ester

9. 2-amino-5-thiazolecarboxylic Acid Ethyl Ester

10. Nsc233051

11. Oprea1_514496

12. Schembl222203

13. Ethyl 2-aminothiazole-5-formate

14. Dtxsid30310861

15. Vnzxerigkznekb-uhfffaoysa-n

16. 2-amino-5-(ethoxycarbonyl)thiazole

17. Cs-d0703

18. Ethyl 2-amino-5-thiazolecarboxylate

19. Ethyl 2-aminothiazole-5-carboxilate

20. Bbl100130

21. Geo-01317

22. Stk377490

23. Ethyl-2-amino Thiazole-5-carboxylate

24. Ethyl-2-amino-thiazole-5-carboxylate

25. Akos005070045

26. Akos015995568

27. Ac-2728

28. Nsc-233051

29. Pb24672

30. 2-aminothiazole-5-carboxylate Ethyl Ester

31. Hy-50301

32. Sy002708

33. Ethyl 2-aminothiazole-5-carboxylate, 97%

34. A5889

35. Am20090492

36. E0907

37. Ft-0630042

38. En300-52389

39. A25920

40. A26945

41. 2-amino Thiazole-5-carboxylic Acid Ethyl Ester

42. 2z-0725

43. F2158-0251

44. Z744606094

45. 2-amino-thiazole-5-carboxylic Acid Ethyl Ester;2-amino-thiazole-5-carboxylate Ethyl Ester

46. Thiazole,2-amino-5-carboxylic Acid Ethyl Ester;ethyl-2-aminothiazole-5-carbonylate

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	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	93.4
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