4-(4-Methyl-1-piperazinylmethyl)benzeneboronic acid pinacol ester

CAS

938043-30-2

Catalog Number

ACM938043302

Category

Other Products

Molecular Weight

316.2

Molecular Formula

C₁₈H₂₉BN₂O₂

MSDS COA Spec Sheet

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Specification

Synonyms

938043-30-2, 1-METHYL-4-[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZYL]PIPERAZINE, 4-(4-Methyl-1-piperazinylmethyl)benzeneboronic acid pinacol ester, 4-((4-Methylpiperazin-1-yl)methyl)phenylboronic acid pinacol ester, 4-(4-METHYLPIPERAZINO)METHYLPHENYLBORONIC ACID, PINACOL ESTER, 1-Methyl-4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)piperazine, SureCN429722, AMTB034, CTK5H3213, ANW-42476, AKOS016002084, AG-H-83613, AM90160, PB26457, AK-64536, B-5606, 4-(4-Methylpiperazino)methylphenylboronic acid, pinacol ester,, 1-METHYL-4-[[4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]METHYL]-PIPERAZINE

IUPAC Name

1-methyl-4-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]piperazine

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)CN3CCN(CC3)C

InChI Key

CYEYLYGHCOHIDC-UHFFFAOYSA-N

Melting Point

61-65ºC

Exact Mass

316.23200

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

368879-17-8
73183-34-3

938043-30-2

Reference: [1] Patent: WO2015/32945, 2015, A1, . Location in patent: Page/Page column 26; 27

Upstream Synthesis Route 2

109-01-3
138500-85-3

938043-30-2

Reference: [1] ACS Combinatorial Science, 2011, vol. 13, # 1, p. 24 - 31
[2] Patent: WO2007/78523, 2007, A2, . Location in patent: Page/Page column 58
[3] Patent: WO2009/10488, 2009, A1, . Location in patent: Page/Page column 57
[4] Bioorganic and Medicinal Chemistry Letters, 2010, vol. 20, # 17, p. 5133 - 5138