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Chemistry

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Also known as: 770-05-8, Dl-octopamine hydrochloride, Octopamine hcl, 4-(2-amino-1-hydroxyethyl)phenol hydrochloride, Epirenor, (+/-)-octopamine hydrochloride
Molecular Formula
C8H12ClNO2
Molecular Weight
189.64  g/mol
InChI Key
PUMZXCBVHLCWQG-UHFFFAOYSA-N
FDA UNII
37YAS5L9HQ

Octopamine Hydrochloride
1 2D Structure

Octopamine Hydrochloride

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-(2-amino-1-hydroxyethyl)phenol;hydrochloride
2.1.2 InChI
InChI=1S/C8H11NO2.ClH/c9-5-8(11)6-1-3-7(10)4-2-6;/h1-4,8,10-11H,5,9H2;1H
2.1.3 InChI Key
PUMZXCBVHLCWQG-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1C(CN)O)O.Cl
2.2 Other Identifiers
2.2.1 UNII
37YAS5L9HQ
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 770-05-8

2. Dl-octopamine Hydrochloride

3. Octopamine Hcl

4. 4-(2-amino-1-hydroxyethyl)phenol Hydrochloride

5. Epirenor

6. (+/-)-octopamine Hydrochloride

7. (+,-)-octopamine Hcl

8. Norfen

9. Octopamine Dl-form Hydrochloride

10. Octopamine (hydrochloride)

11. Mfcd00012881

12. 37yas5l9hq

13. Mls000028414

14. (+,-)-octopamine Hydrochloride

15. 4-(2-amino-1-hydroxyethyl)phenol;hydrochloride

16. 2-amino-1-(4-hydroxyphenyl)ethanol Hydrochloride

17. Norden

18. Nsc-108685

19. Smr000058358

20. Octopamine Hydrochloride (jan)

21. Octopamine Hydrochloride [jan]

22. Octopamine Dl-form Hcl

23. Sr-01000075281

24. Unii-37yas5l9hq

25. D,l-octopamine Hydrochloride

26. 1-(4-hydroxyphenyl)-2-aminoethanol Hydrochloride

27. Octopamine-d3 Hcl

28. Einecs 212-216-4

29. Dl-octopamine, Hcl

30. (+,-)-octopamine

31. Nsc 108685

32. (+/-)-p-octopamine

33. Dl-epirenor Hydrochloride

34. Opera_id_1905

35. Cas-770-05-8

36. Rac Octopamine Hydrochloride

37. Dsstox_cid_13803

38. Dsstox_rid_79096

39. (y)-octopamine Hydrochloride

40. Dsstox_gsid_33803

41. (?)-octopamine Hydrochloride

42. Mls002222303

43. Spectrum1500639

44. Schembl1168914

45. Chembl1367565

46. Dtxsid8033803

47. Hy-b0528a

48. (.+-.)-octopamine Hydrochloride

49. Dl-alpha-(aminomethyl)-p-hydroxybenzylic Alcohol Hydrochloride

50. Hms1570n20

51. Hms1921m17

52. Pharmakon1600-01500639

53. Tox21_200870

54. Tox21_500932

55. Ccg-39784

56. Nsc108685

57. Nsc757399

58. S3188

59. Akos015890655

60. Lp00932

61. 4-(2-amino-1-hydroxyethyl)phenol Hcl

62. Ncgc00015760-04

63. Ncgc00091918-01

64. Ncgc00091918-02

65. Ncgc00094241-01

66. Ncgc00094241-02

67. Ncgc00094241-03

68. Ncgc00094241-04

69. Ncgc00094241-05

70. Ncgc00258424-01

71. Ncgc00261617-01

72. Octopamine Hydrochloride [who-dd]

73. As-14837

74. Sy039785

75. (+/-)-p-octopamaine Hydrochloride

76. Benzenemethanol, Hydrochloride, (.+-.)-

77. Eu-0100932

78. Ft-0654288

79. Ft-0673211

80. Octopamine Dl-form Hydrochloride [mi]

81. Sw197213-3

82. D00178

83. O 0250

84. (+/-)-octopamine Hydrochloride, >=95%, Solid

85. ( Inverted Question Mark)-octopamine Hydrochloride

86. 770o058

87. (+/-)-octopamine Hydrochloride, Analytical Standard

88. Q-201500

89. Sr-01000075281-1

90. Sr-01000075281-5

91. Sr-01000075281-6

92. Sr-01000075281-7

93. Q27256709

94. ( Inverted Exclamation Marka)-p-octopamine Hydrochlorid

95. 4-(2-amino-1-hydroxyethyl)phenol Hydrochloride (1:1)

96. Dl-2-amino-1-(4-hydroxyphenyl)ethanol Hydrochloride

97. (+/-)-1-(4-hydroxyphenyl)-2-amino Ethanol Hydrochloride

98. Alpha-(aminomethyl)-4-hydroxybenzenemethanol Hydrochloride (1:1)

99. Benzenemethanol, .alpha.-(aminomethyl)-4-hydroxy-, Hydrochloride

100. ( Inverted Question Mark)-alpha-(aminomethyl)-4-hydroxybenzyl Alcohol Hydrochloride

101. Benzenemethanol, .alpha.-(aminomethyl)-4-hydroxy-, Hydrochloride (1:1)

102. Benzenemethanol, .alpha.-(aminomethyl)-4-hydroxy-, Hydrochloride, (+/-)-

103. Benzyl Alcohol, .alpha.-(aminomethyl)-p-hydroxy-, Hydrochloride, (+/-)-

2.4 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 189.64 g/mol
Molecular Formula C8H12ClNO2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass189.0556563 g/mol
Monoisotopic Mass189.0556563 g/mol
Topological Polar Surface Area66.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity111
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2

API Reference Price

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12-Jan-2023
03-Jul-2024
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