(E)-1-pentenylboronic acid pinacol ester

• CAS: 161395-96-6
• Catalog Number: ACM161395966
• Category: Boronic Esters
• Molecular Weight: 196.1g/mol
• Molecular Formula: C11H21BO2
• IUPAC Name: 4,4,5,5-tetramethyl-2-[(E)-pent-1-enyl]-1,3,2-dioxaborolane
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C=CCCC
• InChI: InChI=1S/C11H21BO2/c1-6-7-8-9-12-13-10(2,3)11(4,5)14-12/h8-9H,6-7H2,1-5H3/b9-8+
• InChI Key: IMIHEZMTQOARIK-CMDGGOBGSA-N
• Complexity: 205
• Covalently-Bonded Unit Count: 1
• Exact Mass: 196.16346g/mol
• Formal Charge: 0
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 14
• Monoisotopic Mass: 196.16346g/mol
• Rotatable Bond Count: 3

Synthetic Use

Downstream Synthesis Route 1

• 1234215-33-8
• 161395-96-6

• 1234215-48-5

Reference: [1]Whittaker, Aaron M.; Rucker, Richard P.; Lalic, Gojko
[Organic Letters, 2010, vol. 12, # 14, p. 3216 - 3218]

Downstream Synthesis Route 2

• 1303439-03-3
• 161395-96-6

• 1303439-09-9

Reference: [1]Current Patent Assignee: IRM LLC - WO2011/57148, 2011, A1
Location in patent: Page/Page column 103-104

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