CAS 15574-49-9

Chemistry, 3 End Use API, 2 Related Intermediates

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Also known as: 15574-49-9, Ethyl 5-hydroxy-1,2-dimethyl-1h-indole-3-carboxylate, Dimecarbine, Ethyl 5-hydroxy-1,2-dimethylindole-3-carboxylate, Dimecarbin, Ethyl 1,2-dimethyl-5-hydroxyindole-3-carboxylate

Molecular Formula

C₁₃H₁₅NO₃

Molecular Weight

233.26 g/mol

InChI Key

YTBNTDMBGXAOCG-UHFFFAOYSA-N

FDA UNII

Z927X3UJ2W

1 2D Structure

CAS 15574-49-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

ethyl 5-hydroxy-1,2-dimethylindole-3-carboxylate

2.1.2 InChI

InChI=1S/C13H15NO3/c1-4-17-13(16)12-8(2)14(3)11-6-5-9(15)7-10(11)12/h5-7,15H,4H2,1-3H3

2.1.3 InChI Key

YTBNTDMBGXAOCG-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)C)C

2.2 Other Identifiers

2.2.1 UNII

Z927X3UJ2W

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Dimecarbine

2. Dimekarbin

2.3.2 Depositor-Supplied Synonyms

1. 15574-49-9

2. Ethyl 5-hydroxy-1,2-dimethyl-1h-indole-3-carboxylate

3. Dimecarbine

4. Ethyl 5-hydroxy-1,2-dimethylindole-3-carboxylate

5. Dimecarbin

6. Ethyl 1,2-dimethyl-5-hydroxyindole-3-carboxylate

7. Mecarbinate [inn]

8. Mecarbine

9. 1h-indole-3-carboxylic Acid, 5-hydroxy-1,2-dimethyl-, Ethyl Ester

10. Ethyl 1,2-dimethyl-5-hydroxyindole-2-carboxylate

11. Mfcd00451373

12. 5-hydroxy-1,2-dimethyl-1h-indole-3-carboxylic Acid Ethyl Ester

13. Z927x3uj2w

14. Dimecarbin;dimecarbine;dimekarbin

15. Ncgc00160670-01

16. Dimekarbin

17. Dsstox_cid_26289

18. Dsstox_rid_81515

19. Dsstox_gsid_46289

20. Mecarbinato

21. Mecarbinatum

22. Mecarbinatum [inn-latin]

23. Mecarbinato [inn-spanish]

24. Smr001530137

25. Cas-15574-49-9

26. Ba 2676

27. Brn 0193275

28. Unii-z927x3uj2w

29. 1,2-dimethyl-5-hydroxyindole-2-carboxylate Ethyl

30. 5-hydroxy-1,2-dimethylindol-3-carbonsaeureethylester

31. 1,2-dimethyl-3-carbethoxy- 5-hydroxyindole

32. Ec-000.1448

33. Oprea1_078760

34. Oprea1_434116

35. Cbdive_000227

36. 1,2-dimethyl-5-hydroxyindole-3-carboxylate Ethyl

37. 4-22-00-02229 (beilstein Handbook Reference)

38. Ethyl 5-hydroxy-1,2-dimethyl-indole-3-carboxylate

39. Mls004754495

40. Mls006011807

41. F0265-0602

42. Schembl2109102

43. Zinc1652

44. Chembl1881106

45. Dtxsid9046289

46. Amy8970

47. Hms1608h05

48. Hms3655f17

49. Act06257

50. Albb-016100

51. Bcp26910

52. Hy-b0376

53. Tox21_111974

54. Bbl018879

55. S2074

56. Stk140169

57. Akos000271193

58. Tox21_111974_1

59. Ac-1621

60. Ccg-104192

61. Rs-0114

62. Ncgc00160670-03

63. Ncgc00160670-04

64. Sy016493

65. Db-010834

66. Bb 0216474

67. Ft-0637248

68. M2407

69. Sw219644-1

70. En300-15240

71. Ab01566886_01

72. 574e499

73. Ae-641/02016046

74. J-521681

75. Brd-k28405228-001-01-8

76. Q27295159

77. Ethyl 5-hydroxy-1,2-dimethyl-1h-indole-3-carboxylate #

78. F1920-0014

79. 5-hydroxy-1,2-dimethylindole-3-carboxylic Acid Ethyl Ester

80. Methyl 3-ethyl-5-hydroxy-1-methyl-1h-indole-2-carboxylate

2.4 Create Date

2005-03-27

3 Chemical and Physical Properties

Molecular Formula	C₁₃H₁₅NO₃
Molecular Weight	233.26 g/mol
XLogP3	2.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	233.10519334 g/mol
Monoisotopic Mass	233.10519334 g/mol
Topological Polar Surface Area	51.5 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	294
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

15574-49-9

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1,2-Dimethyl-5-hydroxy-1H-Indole-3-...

About the Company

Malladi Drugs & Pharmaceuticals Ltd was founded in 1980 by microbiologist Mr. M L N Sastry. Within a few ...

Malladi Drugs & Pharmaceuticals Ltd was founded in 1980 by microbiologist Mr. M L N Sastry. Within a few years, Malladi established itself as a leader in manufacturing ephedrine and pseudoephedrine salts. Today, it is the leading manufacturer of APIs in the cough and cold segment. It also has a dominant presence in several therapeutic segments like antihistamines, anti-convulsants, anti-depressants and anxiolytics (CNS). Malladi exports its products to around 60 countries and over 85% of its revenue is generated from exports. Its manufacturing facilities have been approved by the FDA, EDQM, KFDA, TGA and various other regulatory agencies.

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15574-49-9

Intermediate Name

Ethyl 5-hydroxy-1,2-dimethyl-1H-ind...

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Established in 2016, a state-of-the-art R&D facility engaged in the development of Novel processes for Bu...

Established in 2016, a state-of-the-art R&D facility engaged in the development of Novel processes for Bulk Actives including Deuterated Actives, Advanced Intermediates and up the value chain. With experience, Anvitha Life Care Private Limited has knowledge and expertise as a leader in chemical research. Every decision is inspired by our main mission, which is to provide the highest standard of product and services to our clients. In this rapidly changing industry, we’ve realized the importance of continually updating our approach to stay relevant in the market, and are committed to just that.

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