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2D Structure
Also known as: 1226-42-2, P-anisil, Anisil, 1,2-bis(4-methoxyphenyl)ethane-1,2-dione, Ethanedione, bis(4-methoxyphenyl)-, Bis(4-methoxyphenyl)ethanedione
Molecular Formula
C16H14O4
Molecular Weight
270.28  g/mol
InChI Key
YNANGXWUZWWFKX-UHFFFAOYSA-N
FDA UNII
98DR7869CR

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1,2-bis(4-methoxyphenyl)ethane-1,2-dione
2.1.2 InChI
InChI=1S/C16H14O4/c1-19-13-7-3-11(4-8-13)15(17)16(18)12-5-9-14(20-2)10-6-12/h3-10H,1-2H3
2.1.3 InChI Key
YNANGXWUZWWFKX-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC1=CC=C(C=C1)C(=O)C(=O)C2=CC=C(C=C2)OC
2.2 Other Identifiers
2.2.1 UNII
98DR7869CR
2.3 Synonyms
2.3.1 MeSH Synonyms

1. P,p'-dimethoxybenzil

2.3.2 Depositor-Supplied Synonyms

1. 1226-42-2

2. P-anisil

3. Anisil

4. 1,2-bis(4-methoxyphenyl)ethane-1,2-dione

5. Ethanedione, Bis(4-methoxyphenyl)-

6. Bis(4-methoxyphenyl)ethanedione

7. 1,2-ethanedione, 1,2-bis(4-methoxyphenyl)-

8. P,p'-dimethoxybenzil

9. Mfcd00008405

10. 1,2-bis(4-methoxyphenyl)-1,2-ethanedione

11. Nsc-19218

12. Bis(4-methoxyphenyl)ethane-1,2-dione

13. 1,2-bis(4-methoxyphenyl)-ethane-1,2-dione

14. Di-p-anisoyl

15. 4,4/'-dimethoxybenzil

16. Einecs 214-960-5

17. Nsc 19218

18. 4,4'-dimethoxybibenzoyl

19. 4,4\'-dimethoxybenzil

20. Ai3-51933

21. 4,4'-dimethoxydibenzoyl

22. 1,2-ethanedione,1,2-bis(4-methoxyphenyl)-

23. Benzil-based Compound, 21

24. Jmc505727 Compound 2

25. Schembl557152

26. 4,4'-dimethoxybenzil, 98%

27. Chembl191513

28. Dtxsid3061631

29. Bdbm22743

30. 98dr7869cr

31. Hms3749o05

32. Bcp26051

33. Nsc19218

34. Nsc602910

35. Stl444351

36. Akos000120033

37. Ccg-267155

38. Cs-7785

39. Nsc-602910

40. Bp-13430

41. Cs-12384

42. Sy048227

43. Db-041676

44. Hy-103610

45. A1028

46. Eu-0000057

47. Ns00023994

48. S5310

49. En300-16758

50. 1,2-bis(4-methoxyphenyl)-1,2-ethanedione #

51. F16181

52. Ae-641/01115007

53. Sr-01000388833

54. P-anisil;1,2-bis(4-methoxyphenyl)ethane-1,2-dione

55. Sr-01000388833-1

56. W-108428

57. Z56766549

58. Inchi=1/c16h14o4/c1-19-13-7-3-11(4-8-13)15(17)16(18)12-5-9-14(20-2)10-6-12/h3-10h,1-2h

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 270.28 g/mol
Molecular Formula C16H14O4
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area52.6
Heavy Atom Count20
Formal Charge0
Complexity302
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1