CAS 84358-13-4

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BUILDING BLOCK

1 Suppliers, 1 End Use APIs, 6 Related Intermediates

1 Suppliers
1 End Use APIs
6 Related Intermediates

Chemistry

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Also known as: 84358-13-4, N-boc-isonipecotic acid, 1-(tert-butoxycarbonyl)piperidine-4-carboxylic acid, 1-boc-piperidine-4-carboxylic acid, Boc-inp-oh, 174316-71-3

Molecular Formula

C₁₁H₁₉NO₄

Molecular Weight

229.27 g/mol

InChI Key

JWOHBPPVVDQMKB-UHFFFAOYSA-N

FDA UNII

AAZ2CAT47B

1 2D Structure

CAS 84358-13-4

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid

2.1.2 InChI

InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-6-4-8(5-7-12)9(13)14/h8H,4-7H2,1-3H3,(H,13,14)

2.1.3 InChI Key

JWOHBPPVVDQMKB-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)O

2.2 Other Identifiers

2.2.1 UNII

AAZ2CAT47B

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 84358-13-4

2. N-boc-isonipecotic Acid

3. 1-(tert-butoxycarbonyl)piperidine-4-carboxylic Acid

4. 1-boc-piperidine-4-carboxylic Acid

5. Boc-inp-oh

6. 174316-71-3

7. Boc-isonipecotic Acid

8. 174286-31-8

9. 1-(tert-butoxycarbonyl)-4-piperidinecarboxylic Acid

10. Mfcd00076999

11. 1-boc-isonipecotic Acid

12. 1-boc-4-piperidinecarboxylic Acid

13. 1-(tert-butoxycarbonyl)piperidine-4-carboxylid Acid

14. 1-tert-butoxycarbonylpiperidine-4-carboxylic Acid

15. 1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic Acid

16. Boc-piperidine-4-carboxylic Acid

17. 1-[(tert-butoxy)carbonyl]piperidine-4-carboxylic Acid

18. Nsc693924

19. Aaz2cat47b

20. 1-tert-butoxycarbonylisonipecotic Acid

21. Nsc-693924

22. N-(tert-butoxycarbonyl)isonipecotic Acid

23. 1,4-piperidinedicarboxylic Acid, 1-(1,1-dimethylethyl) Ester

24. 1-(tert-butoxycarbonyl)isonipecotic Acid

25. 1-tert-butoxycarbonyl-4-piperidinecarboxylic Acid

26. Piperidine-1,4-dicarboxylic Acid 1-tert-butyl Ester

27. Piperidine-1,4-dicarboxylic Acid Mono-tert-butyl Ester

28. 1-boc-4-piperidine Carboxylic Acid

29. 1-[(tert-butyl)oxycarbonyl]piperidine-4-carboxylic Acid

30. 1-(1,1-dimethylethoxycarbonyl)piperidine-4-carboxylic Acid

31. 1-((tert-butyl)oxycarbonyl)piperidine-4-carboxylic Acid

32. 1-{[(1,1-dimethylethyl)oxy]carbonyl}-4-piperidinecarboxylic Acid

33. 1-(((1,1-dimethylethyl)oxy)carbonyl)-4-piperidinecarboxylic Acid

34. Nsc 693924

35. N-boc Isonipecotic Acid

36. Maybridge1_004399

37. Unii-aaz2cat47b

38. Chemdiv2_002867

39. Boc-pic(4)-oh

40. N-tert-butoxycarbonyl-4-piperidinecarboxylic Acid

41. Oprea1_355601

42. Schembl43357

43. Mls000092026

44. 1-(tert-butoxycarbonyl)-piperidine-4-carboxylic Acid

45. N-boc-pperdne-4-carboxylc Acd

46. F2158-1181

47. Chembl1730672

48. Hms553p23

49. Zinc57562

50. Dtxsid70233343

51. Hms1377c07

52. Hms2312g23

53. 1-boc-piperidine4-carboxylic Acid

54. 1-t-butoxycarbonylisonipecotic Acid

55. Act02051

56. Albb-014904

57. Bcp27154

58. Cs-b0844

59. N-boc Piperidine-4-carboxylic Acid

60. N-t-butoxycarbonyl Isonipecotic Acid

61. 1-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic Aci D

62. Bbl001410

63. Stk894922

64. 1-t-butoxycarbonyl-iso-nipecotic Acid

65. N-tert-butoxycarbonylisonipecotic Acid

66. 1-t-butoxycarbonyl-4-carboxypiperidine

67. Akos000200169

68. 1-tert-butoxycarbonyl Isonipecotic Acid

69. Ab02932

70. Ac-1689

71. As-5311

72. Ccg-238482

73. N-tert- Butoxycarbonylisonipecotic Acid

74. N-tert-butoxycarbonyl Isonipecotic Acid

75. Boc-inp-oh, >=99.0% (hplc)

76. N-t-butoxycarbonyl-4-carboxy-piperidine

77. 1-t-butyloxycarbonyl-4-carboxypiperidine

78. N-boc-4-piperidinecarboxylic Acid

79. 1-tert-butoxycarbonyl-4-carboxypiperidine

80. Bp-11615

81. N-(tert-butoxycarbonyl)-isonipecotic Acid

82. N-(tert-butoxycarbonyl)isonipecotinic Acid

83. N-(tert-butyloxycarbonyl)isonipecotic Acid

84. Nci60_033613

85. Smr000026550

86. Sy002328

87. Db-001452

88. Db-005600

89. Am20110207

90. B3241

91. Bb 0265793

92. Ft-0601018

93. Ft-0602618

94. Ft-0721574

95. 1-n-tert-butoxycarbonylisonipecotic Acid

96. En300-13798

97. 1-t-butoxycarbonylpiperidine-4-carboxylic Acid

98. N-t-butoxycarbonyl-piperidine-4-carboxylic Acid

99. 1-(t-butoxycarbonyl)piperidine-4-carboxylic Acid

100. 1-t-butyloxycarbonylpiperidine-4-carboxylic Acid

101. N-(t-butoxycarbonyl)piperidine-4-carboxylic Acid

102. N-t-butyloxycarbonylpiperidine-4-carboxylic Acid

103. N-tert-butoxycarbonyl-4-piperidyl-carboxylic Acid

104. N-tertbutoxycarbonyl-4-piperidine Carboxylic Acid

105. 1 -tert-butoxycarbonyl-piperidine4-carboxylic Acid

106. 1-(t-butoxycarbonyl)-piperidine-4-carboxylic Acid

107. 1-(tert-butoxycarbonyl)4-piperidinecarboxylic Acid

108. 1-(tert-butoxycarbonyl)piperidin-4-carboxylic Acid

109. 1-(tert-butoxycarbonyl)piperidine-4-carboxylicacid

110. 1-(tertbutoxycarbonyl)piperidine-4-carboxylic Acid

111. 1-tert-butoxycarbonyl-piperidine-4-carboxylic Acid

112. 316b713

113. A811632

114. A857951

115. N-tert-butoxycarbonyl-4-piperidine Carboxylic Acid

116. N-tert-butyloxycarbonylpiperidin-4-carboxylic Acid

117. N-tert-butyloxycarbonylpiperidine-4-carboxylic Acid

118. 1-(1,1-dimethylethyl) 1,4-piperidinedicarboxylate

119. 1-(tert-butoxy)carbonylpiperidine-4-carboxylic Acid

120. 1-(tert-butoxycarbonyl)-piperidine4-carboxylic Acid

121. 1-(tertbutoxycarbonyl)-piperidine-4-carboxylic Acid

122. 1-tert-butoxy Carbonyl Piperidine-4-carboxylic Acid

123. 1-tert-butyloxycarbonylpiperidine-4-carboxylic Acid

124. 1-tert.butyloxycarbonylpiperidine-4-carboxylic Acid

125. 4-carboxy-1-(tert-butoxycarbonyl)piperidine

126. J-523519

127. N-(tert-butoxycarbonyl)piperidine-4-carboxylic Acid

128. Piperidine-1,4-dicarboxylic Acid 1-tert Butyl Ester

129. Piperidine-1,4-dicarboxylic Acid Mono-t-butyl Ester

130. Piperidine-1,4-dicarboxylicacidmono-tert-butylester

131. Q-102991

132. Tert-butyl 4-carboxy-1-piperidinecarboxylate

133. 1-(tert-butoxy-carbonyl)piperidine-4-carboxylic Acid

134. 1-(tert-butoxycarbonyl) Piperidine-4-carboxylic Acid

135. 1-(tert-butoxycarbonyl)-4-piperidine Carboxylic Acid

136. 1-(tert.butyloxycarbonyl)-piperidine-4-carboxylic Acid

137. 1-tert.-butyloxycarbonyl-piperidine-4-carboxylic Acid

138. 4-carboxy-piperidine-1-carboxylic Acid T-butyl Ester

139. 4-carboxy-piperidine-1-carboxylic Acid-t-butyl Ester

140. 4-carboxypiperidine-1-carboxylic Acid Tert-butyl Ester

141. N-(tert-butyloxycarbonyl)piperidine-4-carboxylic Acid

142. Piperidine-1,4-dicarboxylic Acid 1 -tert-butyl Ester

143. Z94599681

144. N-tert-butoxycarbonyl-4-piperidylcarboxylic Acid

145. Piperidine- 1,4-dicarboxylic Acid Mono-tert-butyl Ester

146. 1-(1,1-dimethlethoxycarbonyl)-4-piperidinecarboxylic Acid

147. 1-(1,1-dimethyethoxycarbonyl)-4-piperidinecarboxylic Acid

148. 1-(1,1-dimethylethoxycarbonyl)-4-piperidinecarboxylic Acid

149. 1-(1,1-dimethylethyloxycarbonyl)-4-piperidine Carboxylic Acid

150. Piperidine-1,4-dicarboxylic Acid Mono Tert-butyl Ester

151. 1,4-piperidinedicarboxylic-4-14cacid,1-(1,1-dimethylethyl)ester

152. 1-(tert-butoxycarbonyl)piperidine-4-carboxylic Acid;1-boc-piperidine-4-carboxylicacid;1-boc-piperidine-4-carboxylic Acid

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₉NO₄
Molecular Weight	229.27 g/mol
XLogP3	1.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	229.13140809 g/mol
Monoisotopic Mass	229.13140809 g/mol
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	274
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