CAS 3886-69-9

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BUILDING BLOCK

2 Suppliers, 2 End Use APIs, 49 Related Intermediates

2 Suppliers
2 End Use APIs
49 Related Intermediates

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1 Intermediates

1 Intermediates

Chemistry

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Also known as: 3886-69-9, (r)-(+)-1-phenylethylamine, (r)-1-phenylethanamine, (r)-(+)-alpha-methylbenzylamine, (r)-1-phenylethylamine, D-alpha-methylbenzylamine

Molecular Formula

C₈H₁₁N

Molecular Weight

121.18 g/mol

InChI Key

RQEUFEKYXDPUSK-SSDOTTSWSA-N

FDA UNII

V022ZK8GZ5

1 2D Structure

CAS 3886-69-9

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(1R)-1-phenylethanamine

2.1.2 InChI

InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/t7-/m1/s1

2.1.3 InChI Key

RQEUFEKYXDPUSK-SSDOTTSWSA-N

2.1.4 Canonical SMILES

CC(C1=CC=CC=C1)N

2.1.5 Isomeric SMILES

C[C@H](C1=CC=CC=C1)N

2.2 Other Identifiers

2.2.1 UNII

V022ZK8GZ5

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 3886-69-9

2. (r)-(+)-1-phenylethylamine

3. (r)-1-phenylethanamine

4. (r)-(+)-alpha-methylbenzylamine

5. (r)-1-phenylethylamine

6. D-alpha-methylbenzylamine

7. (1r)-1-phenylethan-1-amine

8. (r)-alpha-methylbenzenemethanamine

9. 1-phenethylamine, (+)-

10. (r)-1-phenylethan-1-amine

11. R-(+)-alpha-methylbenzylamine

12. Chembl19969

13. (alphar)-alpha-methylbenzenemethanamine

14. V022zk8gz5

15. (r)-(+)-?-methylbenzylamine

16. (r)-(+)-1-methylbenzylamine

17. Mfcd00064405

18. (r)-alpha-methylbenzylamine

19. (1r)-(+)-1-phenylethylamine

20. Chebi:35322

21. (+)-(r)-alpha-methylbenzylamine

22. Benzenemethanamine, .alpha.-methyl-, (.alpha.r)-

23. [r]-1-phenylethylamine

24. [r]-(+)-1-phenylethylamine

25. (1r)-1-phenylethylamine

26. Unii-v022zk8gz5

27. (r)-a-methylbenzylamine

28. R(+)-

29. A-phenylethylamine

30. Qsc

31. Einecs 223-423-4

32. (r)-phenylethylamine

33. D-1-phenylethylamine

34. (+)-1-phenethylamine

35. (r)-2-phenylethylamine

36. R-(+)-methylbenzylamine

37. (r)1-phenyl-ethylamine

38. (r)-1-phenylethylarnine

39. (r)-1-phenyl Ethylamine

40. 1(r)-phenyl Ethyl Amine

41. (r)-1-phenyl-ethylamine

42. (r)alpha-methylbenzylamine

43. Benzenemethanamine, Alpha-methyl-, (alphar)-

44. (+)-alpha-phenylethylamine

45. (r)-1-phenyl-ethyl-amine

46. Ec 223-423-4

47. (1 R)-1-phenylethanamine

48. (1r)-1-phenyl-ethylamine

49. (r)-(1-phenylethyl)amine

50. R(+)alpha-methylbenzylamine

51. (r)-alpha-methylbenzylarnine

52. Schembl42393

53. (r)-(+)-1-phenethylamine

54. (r)-1-(phenyl)-ethylamine

55. (r)-alpha-methyl Benzylamine

56. [(1r)-1-phenylethyl]amine

57. Alpha-formylmandeloyl Chloride

58. R-(+)-alpha-phenylethylamine

59. (r)-(+)-a-methylbenzylamine

60. (1r)-1-phenyl-1-ethanamine

61. (r)-(-)-1-phenylethylamine

62. D-(+)-2-amino-1-butanol

63. R-(+)-alpha Methylbenzylamine

64. Schembl4165369

65. D-.alpha.-phenethylamine

66. (r)-(+)-

67. A-methylbenzylamine

68. Dtxsid80930735

69. (r)-(-)-alpha-methylbenzylamine

70. Rqeufekyxdpusk-ssdottswsa-n

71. (r)-(+)-alpha-methyl Benzylamine

72. (r)-(+)-alpha-methyl-benzylamine

73. (r)-(+)-alpha-methylbenzyl Amine

74. D-.alpha.-methylbenzylamine

75. (r)-(+)- Alpha -methylbenzylamine

76. Bdbm50028628

77. (r)-(+)-1-phenylethanamine

78. Akos005256786

79. Ac-8773

80. Cs-w008645

81. (+)-(r)-alpha-methylbenzenemethanamine

82. (+)-(r)-alpha-methyl-benzenemethanamine

83. (r)-(+)-alpha-methylbenzylamine, 98%

84. (r)-(+)-alpha-methylbenzylamine (>85%)

85. A6546

86. Am20060613

87. P0794

88. En300-67366

89. D77692

90. .alpha.-methylbenzylamine (+)-form [mi]

91. Q-200619

92. Q-200923

93. Q27116453

94. F8889-8738

95. Z1079183182

96. (r)-(+)-alpha-methylbenzylamine, >=99%, Chiraselect(tm)

97. (r)-(+)-alpha-methylbenzylamine, Chipros(r), Produced By Basf, >=99.0%

98. (r)-(+)-alpha-methylbenzylamine, For Chiral Derivatization, >=99.0%

99. Levetiracetam Impurity E, European Pharmacopoeia (ep) Reference Standard

100. (r)-(+)-alpha-methylbenzylamine, Purum, >=98.0% (sum Of Enantiomers, Gc)

101. (alphar)-alpha-methyl-benzenemethanamine (+)-alpha-phenethylamine (r)-1-amino-1-phenylethane

2.4 Create Date

2005-07-19

3 Chemical and Physical Properties

Molecular Formula	C₈H₁₁N
Molecular Weight	121.18 g/mol
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	26
Heavy Atom Count	9
Formal Charge	0
Complexity	74.6
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1