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Structure

2-Methoxypyrimidine-5-boronic acid pinacol ester

CAS
1052686-60-8
Catalog Number
ACM1052686608
Category
Other Products
Molecular Weight
236.075280 [g/mol]
Molecular Formula
C11H17BN2O3
MSDS COA Spec Sheet

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Specification

Synonyms
2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine, 1052686-60-8, PubChem23510, SureCN1096510, MolPort-020-003-418, AKOS016012320, AK122450, KB-231172, AM20070703
IUPAC Name
2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine
Canonical SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN=C(N=C2)OC
InChI Key
NPIOFBGJGBMTRC-UHFFFAOYSA-N
Exact Mass
236.13300
H-Bond Acceptor
5
H-Bond Donor
0

Upstream Synthesis Route 1

  • 73183-34-3
  • 14001-66-2
  • 1052686-60-8

Reference: [1] Bioorganic and Medicinal Chemistry Letters, 2011, vol. 21, # 19, p. 5849 - 5853
[2] Patent: US9138427, 2015, B2, . Location in patent: Page/Page column 290
[3] Patent: WO2017/197151, 2017, A1, . Location in patent: Page/Page column 40

Upstream Synthesis Route 2

  • 185990-03-8
  • 14001-66-2
  • 1052686-60-8

Reference: [1] Chemical Science, 2015, vol. 6, # 5, p. 2943 - 2951

Downstream Synthesis Route 1

  • 1052686-60-8
  • 6943-69-7
  • 1052686-66-4

Reference: [1]Journal of Medicinal Chemistry,2008,vol. 51,p. 5243 - 5263

Downstream Synthesis Route 2

  • 1052686-60-8
  • 1161730-54-6
  • 1161730-56-8

Reference: [1]Patent: US2009/163464,2009,A1 .Location in patent: Page/Page column 47

Downstream Synthesis Route 3

  • 1052686-60-8
  • 1312942-01-0
  • 1312940-70-7

Reference: [1]Patent: WO2011/79133,2011,A2 .Location in patent: Page/Page column 154

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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