3-(Morpholine-4-carbonyl)phenylboronic acid pinacol ester

CAS

1036991-25-9

Catalog Number

ACM1036991259

Category

Other Products

Molecular Weight

317.2

Molecular Formula

C₁₇H₂₄BNO₄

MSDS COA Spec Sheet

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Specification

Synonyms

1036991-25-9, 3-(Morpholine-4-carbonyl)phenylboronic acid pinacol ester, AMTB027, CTK8B3829, ANW-43263, AKOS016004779, AK-84713, KB-27188, A-4294, [3-(Morpholine-4-carbonyl)phenyl]boronic acid pinacol ester, 3-(4-Morpholinylcarbonyl)phenylboronic acid pinacol ester, 3-(4-Morpholinylcarbonyl)phenylboronic acid pinacol ester,, 4-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoyl]morpholine, Morpholino(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanone

IUPAC Name

morpholin-4-yl-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanone

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)C(=O)N3CCOCC3

InChI Key

PKONGXZPUDFPPH-UHFFFAOYSA-N

Exact Mass

317.18000

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

110-91-8
269409-73-6

1036991-25-9

Reference: [1]European Journal of Medicinal Chemistry,2012,vol. 54,p. 311 - 323
[2]Bioorganic and Medicinal Chemistry,2012,vol. 20,p. 5012 - 5016

Upstream Synthesis Route 2

76-09-5

1036991-25-9

Reference: [1]Chini, Maria Giovanna; De Simone, Rosa; Bruno, Ines; Riccio, Raffaele; Dehm, Friederike; Weinigel, Christina; Barz, Dagmar; Werz, Oliver; Bifulco, Giuseppe
[European Journal of Medicinal Chemistry, 2012, vol. 54, p. 311 - 323]
[2]De Simone, Rosa; Bruno, Ines; Riccio, Raffaele; Stadler, Katharina; Bauer, Julia; Schaible, Anja M.; Laufer, Stefan; Werz, Oliver
[Bioorganic and Medicinal Chemistry, 2012, vol. 20, # 16, p. 5012 - 5016]

Downstream Synthesis Route 1

1271724-99-2
1036991-25-9

1394824-96-4

Reference: [1]Location in patent: experimental part
Chini, Maria Giovanna; De Simone, Rosa; Bruno, Ines; Riccio, Raffaele; Dehm, Friederike; Weinigel, Christina; Barz, Dagmar; Werz, Oliver; Bifulco, Giuseppe
[European Journal of Medicinal Chemistry, 2012, vol. 54, p. 311 - 323]

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

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