3-Morpholinophenylboronic acid pinacol ester

• CAS: 852227-95-3
• Catalog Number: ACM852227953
• Category: Other Products
• Molecular Weight: 289.18
• Molecular Formula: C₁₆H₂₄BNO₃
• Synonyms: 852227-95-3, 4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine, 3-morpholinophenylboronic acid pinacol ester, AG-H-42624, 4-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)morpholine, 3-hydroxy-2,3-dimethylbutan-2-yl hydrogen 3-morpholinophenylboronate, PubChem19450, AC1N5BYR, SureCN856181, KSC496K1F, CTK3J6512, MolPort-000-141-270, ACT02210, ANW-41811, AKOS015920432, AB14370, CC33839, QC-4655, RP06724, AK-36573
• IUPAC Name: 4-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)N3CCOCC3
• InChI Key: NCJDKFFODGZRRL-UHFFFAOYSA-N
• H-Bond Acceptor: 4
• H-Bond Donor: 0

Synthetic Use

Upstream Synthesis Route 1

• 5414-19-7
• 210907-84-9

• 852227-95-3

Reference: [1] Patent: WO2012/167423, 2012, A1, . Location in patent: Page/Page column 37

Upstream Synthesis Route 2

• 73183-34-3
• 197846-82-5

• 852227-95-3

Reference: [1] Journal of Medicinal Chemistry, 2015, vol. 58, # 14, p. 5522 - 5537
[2] Journal of Medicinal Chemistry, 2013, vol. 56, # 10, p. 3820 - 3832

Upstream Synthesis Route 3

• 96042-30-7
• 73183-34-3
• 197846-82-5

• 852227-95-3

Reference: [1] Patent: US2009/118305, 2009, A1,