CAS 114772-38-2

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44 Related Intermediates

Chemistry

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Also known as: 114772-38-2, Methyl 4'-bromomethyl biphenyl-2-carboxylate, Methyl 4'-(bromomethyl)biphenyl-2-carboxylate, 133240-26-3, Methyl 4'-(bromomethyl)-[1,1'-biphenyl]-2-carboxylate, Methyl 4'-bromomethylbiphenyl-2-carboxylate

Molecular Formula

C₁₅H₁₃BrO₂

Molecular Weight

305.17 g/mol

InChI Key

RMXGTMRDXKUUDJ-UHFFFAOYSA-N

1 2D Structure

CAS 114772-38-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

methyl 2-[4-(bromomethyl)phenyl]benzoate

2.1.2 InChI

InChI=1S/C15H13BrO2/c1-18-15(17)14-5-3-2-4-13(14)12-8-6-11(10-16)7-9-12/h2-9H,10H2,1H3

2.1.3 InChI Key

RMXGTMRDXKUUDJ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

COC(=O)C1=CC=CC=C1C2=CC=C(C=C2)CBr

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 114772-38-2

2. Methyl 4'-bromomethyl Biphenyl-2-carboxylate

3. Methyl 4'-(bromomethyl)biphenyl-2-carboxylate

4. 133240-26-3

5. Methyl 4'-(bromomethyl)-[1,1'-biphenyl]-2-carboxylate

6. Methyl 4'-bromomethylbiphenyl-2-carboxylate

7. 4'-bromomethyl-(1,1'-biphenyl)-2-carboxylic Acid Methyl Ester

8. Methyl 4'-bromomethyl-2-biphenylcarboxylate

9. Methyl 4'-bromomethyl-biphenyl-2-carboxylate

10. [1,1'-biphenyl]-2-carboxylic Acid, 4'-(bromomethyl)-, Methyl Ester

11. 4'-bromomethylbiphenyl-2-carboxylic Acid, Methyl Ester

12. Mfcd06200816

13. Telmisartan Related Compound

14. Methyl 4/'-bromomethylbiphenyl-2-carboxylate

15. 4'-bromomethylbiphenyl-2-carboxylic Acid Methyl Ester

16. Methyl 2-(4-(bromomethyl)phenyl)benzoate

17. 2-[4-(bromomethyl)phenyl]benzoic Acid Methyl Ester

18. Methyl 4'-(bromomethyl)[1,1'-biphenyl]-2-carboxylate

19. Methyl 4'-(bromomethyl)-(1,1'-biphenyl)-2-carboxylate

20. 2'-(methoxycarbonyl)biphenyl-4-ylmethyl Bromide

21. Methyl 2-(4'-bromomethylphenyl)benzoate

22. Schembl562

23. Ec 601-325-6

24. Rmxgtmrdxkuudj-uhfffaoysa-

25. Dtxsid70921490

26. Bcp12011

27. Zinc21297450

28. 4'-bromomethyl-2-carbomethoxybiphenyl

29. Akos015888233

30. Ab23054

31. Ac-2016

32. Am90278

33. Methyl 2-(4-bromomethylphenyl)benzoate

34. Methyl 2-(4'-bromomethlphenyl)benzoate

35. 4-bromomethyl-2'-methoxycarbonylbiphenyl

36. Methyl 2-(4'-bromomethylpbenyl)benzoate

37. Methyl2-[4-(bromomethyl)phenyl]benzoate

38. 4-bromomethyl-2'-methoxycarbonyl-biphenyl

39. As-11906

40. Sy035596

41. Db-062964

42. Ft-0642791

43. M1806

44. Methyl 4\'-bromomethyl Biphenyl-2-carboxylate

45. Methyl 4'-(bromomethyl)-biphenyl-2-carboxylate

46. A803229

47. Methyl 4'-bromomethyl-1,1'-biphenyl-2-carboxylate

48. Q-201376

49. 4'-(bromomethyl)biphenyl-2-carboxylic Acid Methyl Ester

50. Methyl 4'-(bromomethyl)-(1,1'-biphenyl)-2 -carboxylate

51. [(2'-(methoxycarbonyl)-(1,1'-biphenyl)-4-yl)-methyl]-bromide

52. Methyl 4 Inverted Exclamation Mark -(bromomethyl)biphenyl-2-carboxylate

53. 4 Inverted Exclamation Mark -bromomethylbiphenyl-2-carboxylic Acid, Methyl Ester

54. Telmisartan Bromo Methyl Ester Impurity;methyl 2-[4-(bromomethyl)phenyl]benzoate;2-[4-(bromomethyl)phenyl]benzoic Acid Methyl Ester

2.3 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₁₅H₁₃BrO₂
Molecular Weight	305.17 g/mol
XLogP3	4.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	304.00989 g/mol
Monoisotopic Mass	304.00989 g/mol
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	272
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