N-Methylpyrrole-2-boronic acid,pinacol ester

• CAS: 850567-47-4
• Catalog Number: ACM850567474
• Category: Other Products
• Molecular Weight: 207.08g/mol
• Molecular Formula: C11H18BNO2
• IUPAC Name: 1-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrole
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=CN2C
• InChI: InChI=1S/C11H18BNO2/c1-10(2)11(3,4)15-12(14-10)9-7-6-8-13(9)5/h6-8H,1-5H3
• InChI Key: OEQQEXKRORJZPR-UHFFFAOYSA-N
• Complexity: 239
• Covalently-Bonded Unit Count: 1
• Exact Mass: 207.143059g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 15
• Monoisotopic Mass: 207.143059g/mol
• Rotatable Bond Count: 1

Synthetic Use

Upstream Synthesis Route 1

• 96-54-8
• 25015-63-8

• 850567-47-4

Reference: [1]Légaré Lavergne, Julien; Jayaraman, Arumugam; Misal Castro, Luis C.; Rochette, Étienne; Fontaine, Frédéric-Georges
[Journal of the American Chemical Society, 2017, vol. 139, # 41, p. 14714 - 14723]

Upstream Synthesis Route 2

• 96-54-8
• 76-09-5

• 953040-54-5
• 850567-47-4

Reference: [1]Del Grosso, Alessandro; Singleton, Paul J.; Muryn, Christopher A.; Ingleson, Michael J.
[Angewandte Chemie - International Edition, 2011, vol. 50, # 9, p. 2102 - 2106]

Downstream Synthesis Route 1

• 850567-47-4
• 92-66-0

• 1101205-38-2

Reference: [1]Deng, James Z.; Paone, Daniel V.; Ginnetti, Anthony T.; Kurihara, Hideki; Dreher, Spencer D.; Weissman, Steven A.; Stauffer, Shaun R.; Burgey, Christopher S.
[Organic Letters, 2009, vol. 11, # 2, p. 345 - 347]

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