Close
4
FDA-&-EMA-New-Drug Approvals(Mid-2020 Recap)-insert
X

Overview

Client Email Product
CAS 1667-01-2
PharmaCompass
  • Chemistry
CAS 1667-01-2
Also known as: 1667-01-2, 1-mesitylethanone, 2',4',6'-trimethylacetophenone, Acetomesitylene, Mesityl methyl ketone, 1-(2,4,6-trimethylphenyl)ethanone
Molecular Formula
C11H14O
Molecular Weight
162.232  g/mol
InChI Key
XWCIICLTKWRWCI-UHFFFAOYSA-N

1 2D Structure

CAS 1667-01-2

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-(2,4,6-trimethylphenyl)ethanone
2.1.2 InChI
InChI=1S/C11H14O/c1-7-5-8(2)11(10(4)12)9(3)6-7/h5-6H,1-4H3
2.1.3 InChI Key
XWCIICLTKWRWCI-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=CC(=C(C(=C1)C)C(=O)C)C
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 1667-01-2

2. 1-mesitylethanone

3. 2',4',6'-trimethylacetophenone

4. Acetomesitylene

5. Mesityl Methyl Ketone

6. 1-(2,4,6-trimethylphenyl)ethanone

7. Ethanone, 1-(2,4,6-trimethylphenyl)-

8. 2-acetylmesitylene

9. 2,4,6-trimethylacetophenone

10. Methyl 2,4,6-trimethylphenyl Ketone

11. 1,3,5-trimethyl-2-acetylbenzene

12. 1-acetyl-2,4,6-trimethylbenzene

13. Nsc 65636

14. Acetophenone, 2',4',6'-trimethyl-

15. Xwciicltkwrwci-uhfffaoysa-n

16. Sbb058303

17. 1-(2,4,6-trimethylphenyl)-1-ethanone

18. 1-(2,4,6-trimethylphenyl)ethan-1-one

19. Einecs 216-783-9

20. 1-mesitylethanone #

21. Methyl Mesityl Ketone

22. 1-mesitylethan-1-one

23. Ai3-11164

24. Ac1q1jbv

25. Acmc-1arx2

26. Ac1l25xu

27. Nciopen2_000113

28. 2',6'-trimethylacetophenone

29. Schembl698413

30. 2,4,6-trimethyl-acetophenone

31. 1,5-trimethyl-2-acetylbenzene

32. Acetophenone,4',6'-trimethyl-

33. Dtxsid1061865

34. Ethanone,4,6-trimethylphenyl)-

35. Molport-000-159-272

36. Methyl 2,6-trimethylphenyl Ketone

37. 2',4', 6'-trimethylacetophenone

38. Albb-022477

39. Nsc65636

40. Zinc1081287

41. 2', 4', 6'-trimethylacetophenone

42. 8487aa

43. Anw-22227

44. Mfcd00008735

45. Nsc-65636

46. Stl281391

47. 1-(2,4,6-trimethylphenyl)-ethanone

48. Akos000120526

49. 1-(2,4,6-trimethyl-phenyl)-ethanone

50. Mcule-7679488813

51. Vz22420

52. 51885-97-3

53. Aj-24937

54. Ak-62390

55. As-10615

56. Bp-12622

57. Kb-17220

58. Sc-22250

59. Zb015920

60. Db-019843

61. Rt-002860

62. Am20030116

63. Bg01501197

64. Ft-0609895

65. Ft-0693011

66. R1204

67. St24032227

68. St50307932

69. Acetophenone, 2',4',6'-trimethyl- (8ci)

70. A810757

71. 2',4',6'-trimethylacetophenone, >=98.0% (gc)

72. W-109691

73. I01-10214

74. F2146-0688

75. Inchi=1/c11h14o/c1-7-5-8(2)11(10(4)12)9(3)6-7/h5-6h,1-4h

2.3 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 162.232 g/mol
Molecular Formula C11H14O
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass162.104 g/mol
Monoisotopic Mass162.104 g/mol
Topological Polar Surface Area17.1 A^2
Heavy Atom Count12
Formal Charge0
Complexity162
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty

Advertise With Us

Advertise With Us