CAS 120-20-7

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Also known as: 120-20-7, Homoveratrylamine, 2-(3,4-dimethoxyphenyl)ethanamine, 3,4-dimethoxyphenylethylamine, 2-(3,4-dimethoxyphenyl)ethylamine, Dimethoxyphenylethylamine

Molecular Formula

C₁₀H₁₅NO₂

Molecular Weight

181.23 g/mol

InChI Key

ANOUKFYBOAKOIR-UHFFFAOYSA-N

FDA UNII

IQF9T435OP

A derivative of phenethylamine containing two substituent methoxy groups in the phenyl ring.

1 2D Structure

CAS 120-20-7

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-(3,4-dimethoxyphenyl)ethanamine

2.1.2 InChI

InChI=1S/C10H15NO2/c1-12-9-4-3-8(5-6-11)7-10(9)13-2/h3-4,7H,5-6,11H2,1-2H3

2.1.3 InChI Key

ANOUKFYBOAKOIR-UHFFFAOYSA-N

2.1.4 Canonical SMILES

COC1=C(C=C(C=C1)CCN)OC

2.2 Other Identifiers

2.2.1 UNII

IQF9T435OP

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Dimethoxyphenylethylamine

2.3.2 Depositor-Supplied Synonyms

1. 120-20-7

2. Homoveratrylamine

3. 2-(3,4-dimethoxyphenyl)ethanamine

4. 3,4-dimethoxyphenylethylamine

5. 2-(3,4-dimethoxyphenyl)ethylamine

6. Dimethoxyphenylethylamine

7. Dmpea

8. Benzeneethanamine, 3,4-dimethoxy-

9. Dimethoxydopamine

10. Dimethylmescaline

11. Dopamine Dimethyl Ether

12. Dimpea

13. O,o-dimethyldopamine

14. 3,4-dimethoxybenzeneethanamine

15. 3,4-di-o-methyldopamine

16. 3,4-dimethoxydopamine

17. 3,4-dimethoxy-beta-phenylethylamine

18. 3,4-dimethoxyphenylethylamine(base)

19. Beta-(3,4-dimethyoxyphenyl)ethylamine

20. 3,4-dimethoxy Phenethylamine

21. 2-(3,4-dimethoxyphenyl)-ethylamine

22. 2-(3,4-dimethoxy-phenyl)-ethylamine

23. 2-(3,4-dimethoxyphenyl)ethan-1-amine

24. Mfcd00008188

25. Nsc 16948

26. 3,4-dimethoxy Phenylethylamine

27. Phenethylamine, 3,4-dimethoxy-

28. Chebi:136995

29. 3,4-dimethoxy-.beta.-phenylethylamine

30. 3,4-dimethoxypheneethylamine

31. Iqf9t435op

32. 3,4-dimethyloxyphenylethylamine

33. Nsc-6328

34. 3,4-dimethoxy-.beta.-phenethylamine

35. Beta-(3,4-dimethoxyphenyl)ethylamine

36. Nsc-16948

37. Nsc-26152

38. .beta.-(3,4-dimethoxyphenyl)ethylamine

39. Phenethylamine,4-dimethoxy-

40. Dopamine Impurity C (3,4-dimethoxyphenethylamine)

41. Benzeneethanamine,4-dimethoxy-

42. Wln: Z2r Co1 Do1

43. Smr000112358

44. Einecs 204-376-9

45. 3,4-dimethoxyphenylethylamine (base)

46. Unii-iqf9t435op

47. Brn 0474393

48. Ai3-23876

49. Homoveratryl Amine

50. 3,4-dimethoxy-phenethylamine

51. Homoveratrilamine

52. Dopamine Impurity C

53. Epitope Id:119694

54. Ec 204-376-9

55. Nciopen2_005995

56. Oprea1_397610

57. 3, 4-dimethoxyphenethylamine

58. 3,4-dimethoxyphenethyl Amine

59. 4-13-00-02604 (beilstein Handbook Reference)

60. Mls000515889

61. Mls001424180

62. Chembl26019

63. Schembl210639

64. 3,4-di-methoxy-phenethylamine

65. 3,4-dimethyoxyphenylethylamine

66. 3,4-dimethoxy-phenylethylamine

67. 3,4-dimethoxy-benzenethanamine

68. Schembl7319619

69. 3, 4-dimethoxybenzeneethanamine

70. B-3,4-dimethoxyphenylethylamine

71. 3,4-dimethoxy-benzeneethanamine

72. Dtxsid8059506

73. Phenethyl Amine, 3,4-dimethoxy

74. Nsc6328

75. 2(3,4-dimethoxyphenyl)ethylamine

76. Benzenethanamine, 3,4-dimethoxy-

77. 3,4-dimethoxy-beta-phenethylamine

78. B-(3,4-dimethoxyphenyl)ethylamine

79. Hms2052a09

80. Hms2269o22

81. Hms3394a09

82. Zinc388739

83. 3,4-dimethoxyphenethylamine, 97%

84. 3, 4-dimethoxy-beta-phenethylamine

85. Hy-y0935

86. Nsc16948

87. Nsc26152

88. Akos Bbs-00003591

89. B-(3,4-dimethoxyphenyl)ethyl Amine

90. 2-(3,4-dimethoxy-phenyl)ethylamine

91. 2-(3,4-dimethoxyphenyl) Ethylamine

92. 3,4-dimethoxyphenethylamine, Pract.

93. Bbl023006

94. Stk397473

95. 3, 4-dimethoxy-beta-phenylethylamine

96. 3, 4-dimethoxyphenylethylamine(base)

97. 3,4-dimethoxy-beta-phenyl-ethylamine

98. [2-(3,4-dimethoxyphenyl)ethyl]amine

99. 2-(3,4-dimethoxy Phenyl)ethyl Amine

100. 2-(3,4-dimethoxy-phenyl)ethyl Amine

101. 2-(3,4-dimethoxyphenyl)ethanamine #

102. Akos000104026

103. Beta-(3,4-dimethoxyphenyl)-ethylamine

104. Ac-8488

105. Ccg-101095

106. Cs-w023192

107. Fs-4041

108. Nc00345

109. 2-(3',4'-dimethoxyphenyl)-ethylamine

110. Beta-(3,4 -dimethoxyphenyl) Ethylamine

111. Ncgc00247022-01

112. Db-001827

113. Db-003355

114. Am20060494

115. D0678

116. Ft-0608529

117. 120h207

118. Q4634069

119. W-108484

120. 2-(3,4-dimethoxyphenyl)ethanamine (acd/name 4.0)

121. 2-(3,4-dimethoxyphenyl)ethylamine (acd/name 4.0)

122. Dopamine Hydrochloride Impurity C [ep Impurity]

123. F2190-0398

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₅NO₂
Molecular Weight	181.23 g/mol
XLogP3	0.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	181.110278721 g/mol
Monoisotopic Mass	181.110278721 g/mol
Topological Polar Surface Area	44.5 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	141
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