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Overview of CAS 98446-49-2

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4L-348S
PharmaCompass
4L-348S
Also known as: 98446-49-2, 5-amino-2,4-dichloroanisole, 2,4-dichloro-5-methoxybenzenamine, 4,6-dichloro-m-anisidine, 2,4-dichloro-5-methoxy-phenylamine, Benzenamine, 2,4-dichloro-5-methoxy-
Molecular Formula
C7H7Cl2NO
Molecular Weight
192.039  g/mol
InChI Key
AJROJTARXSATEB-UHFFFAOYSA-N

1 2D Structure

4L-348S

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2,4-dichloro-5-methoxyaniline
2.1.2 InChI
InChI=1S/C7H7Cl2NO/c1-11-7-3-6(10)4(8)2-5(7)9/h2-3H,10H2,1H3
2.1.3 InChI Key
AJROJTARXSATEB-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=C(C=C(C(=C1)N)Cl)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 98446-49-2

2. 5-amino-2,4-dichloroanisole

3. 2,4-dichloro-5-methoxybenzenamine

4. 4,6-dichloro-m-anisidine

5. 2,4-dichloro-5-methoxy-phenylamine

6. Benzenamine, 2,4-dichloro-5-methoxy-

7. 2,4-dichloro-5-methoxyphenylamine

8. Sbb059074

9. Dichloromethoxyaniline

10. Pubchem4393

11. Acmc-209sae

12. 4,5-dichloro-m-anisidine

13. Ac1lrs73

14. Ksc486m7l

15. Mls000707240

16. Schembl108063

17. Chembl1385409

18. 2,4-di-chloro-5-methoxyaniline

19. Ctk3i6675

20. Dtxsid80363100

21. Ajrojtarxsateb-uhfffaoysa-n

22. Molport-001-768-746

23. Hms2648d09

24. Act08738

25. Ebd16522

26. Zinc1388874

27. 5-amino-4,6-dichloroanisole

28. Anw-40932

29. Cl9088

30. Mfcd00974410

31. Benzenamine,2,4-dichloro-5-methoxy-

32. Akos005070483

33. 4l-348s

34. Ac-4783

35. As00411

36. As02882

37. Cm10056

38. Ls10683

39. Mcule-6100376005

40. Qc-6146

41. Rp11352

42. Rtc-020751

43. Vz30014

44. 2,4-dichloro-5-methoxylaniline

45. Ks-0000019b

46. Aj-25478

47. Ak-37012

48. Cj-04876

49. Kb-17361

50. Or023702

51. Sc-07504

52. Smr000334622

53. Sy032192

54. Zb016871

55. Ab0020397

56. Db-024742

57. St2415760

58. Tc-020751

59. C2963

60. Ft-0642369

61. St50826734

62. V1252

63. C-5860

64. 446d492

65. I01-1780

66. J-507133

67. 2,4-dichloro-5-methoxyaniline4,6-dichloro-m-anisidine

68. 5-amino-2,4-dichloroanisole, 4,5-dichloro-m-anisidine

69. Benzo[b]furan-2-boronic Acid; 2,3-benzo[b]furan-2-boronic Acid

2.3 Create Date
2005-07-11
3 Chemical and Physical Properties
Molecular Weight 192.039 g/mol
Molecular Formula C7H7Cl2NO
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass190.99 g/mol
Monoisotopic Mass190.99 g/mol
Topological Polar Surface Area35.2 A^2
Heavy Atom Count11
Formal Charge0
Complexity134
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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