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Overview of Methyl 4'-Methyl-[1,1'-Biphenyl]-2-Carboxylate

Client Email Product
4CH-018262
PharmaCompass
4CH-018262
Also known as: 114772-34-8, 4'-methylbiphenyl-2-carboxylic acid methyl ester, Methyl 4'-methyl-[1,1'-biphenyl]-2-carboxylate, Methyl 4'-methylbiphenyl-2-carboxylate, Methyl 2-(p-tolyl)benzoate, [1,1'-biphenyl]-2-carboxylic acid, 4'-methyl-, methyl ester
Molecular Formula
C15H14O2
Molecular Weight
226.275  g/mol
InChI Key
IHNIAWHITVGYJJ-UHFFFAOYSA-N

1 2D Structure

4CH-018262

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl 2-(4-methylphenyl)benzoate
2.1.2 InChI
InChI=1S/C15H14O2/c1-11-7-9-12(10-8-11)13-5-3-4-6-14(13)15(16)17-2/h3-10H,1-2H3
2.1.3 InChI Key
IHNIAWHITVGYJJ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)OC
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 114772-34-8

2. 4'-methylbiphenyl-2-carboxylic Acid Methyl Ester

3. Methyl 4'-methyl-[1,1'-biphenyl]-2-carboxylate

4. Methyl 4'-methylbiphenyl-2-carboxylate

5. Methyl 2-(p-tolyl)benzoate

6. [1,1'-biphenyl]-2-carboxylic Acid, 4'-methyl-, Methyl Ester

7. Methyl 4'-methyl[1,1'-biphenyl]-2-carboxylate

8. Pubchem8930

9. Ac1lrdjl

10. Schembl249

11. Acmc-2099lj

12. Methyl2-(p-tolyl)benzoate

13. Amtda184

14. Met040

15. Jsp001089

16. Ctk4a8891

17. Dtxsid00362716

18. Ihniawhitvgyjj-uhfffaoysa-n

19. Molport-000-157-115

20. Bm070

21. Zxba000053

22. Zinc1259344

23. Zx-at018316

24. Methyl 2-(4'-methylphenyl)benzoate

25. Anw-16709

26. Cm-027

27. Sbb063209

28. Methyl 4'methylbiphenyl-2-carboxylate

29. 2-(p-tolyl)benzoic Acid Methyl Ester

30. 4 Inverted Exclamation Mark -methylbiphenyl-2-carboxylic Acid Methyl Ester

31. Akos004114791

32. 4-methyl Methyl Biphenyl-2-carboxylate

33. Ac-6373

34. Am90277

35. As-3158

36. Methyl 4'-methyl-2-biphenylcarboxylate

37. Or10997

38. Rl00576

39. Ks-0000148t

40. Methyl 4'-methyl-biphenyl-2-carboxylate

41. Aj-25264

42. Ak-87648

43. An-10109

44. Cc-19915

45. I878

46. Sc-25706

47. Zb016196

48. Ab0013919

49. Ax8015923

50. Db-002803

51. Kb-146131

52. Rt-019886

53. St2407221

54. Tl8000421

55. 4ch-018262

56. Bb 0223440

57. Ft-0642789

58. M1809

59. Methyl 4'-methyl-1,1'-biphenyl-2-carboxylate

60. Methyl 4'-methyl-(1,1'biphenyl)-2-carboxylate

61. 4'-methyl-biphenyl-2-carboxylic Acid Methyl Ester

62. 772m348

63. C-12885

64. I01-0863

65. J-003130

66. J-522379

67. Methyl 4'-methyl-(1, 1'-biphenyl)-2-carboxylate

68. Methyl-4'-methyl-1,1'-biphenyl-2-carboxylate

69. [1,1'-biphenyl]-2-carboxylic Acid,4'-methyl-,methyl Ester

70. [1,1'-biphenyl]-2-carboxylicacid, 4'-methyl-, Methyl Ester

71. 4'-methylbiphenyl-2-carboxylic Acid Methyl Ester, Aldrichcpr

2.3 Create Date
2005-07-11
3 Chemical and Physical Properties
Molecular Weight 226.275 g/mol
Molecular Formula C15H14O2
XLogP34.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass226.099 g/mol
Monoisotopic Mass226.099 g/mol
Topological Polar Surface Area26.3 A^2
Heavy Atom Count17
Formal Charge0
Complexity254
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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