4-(Piperazine-1-carbonyl)phenylboronic acid, pinacol ester

• CAS: 864754-07-4
• Catalog Number: ACM864754074
• Category: Boronic Esters
• Molecular Weight: 316.2
• Molecular Formula: C₁₇H₂₅BN₂O₃
• Synonyms: FS000517, 4-(Piperazine-1-carbonyl)phenylboronic acid pinacol ester, 864754-07-4
• IUPAC Name: piperazin-1-yl-[4-(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=C(C=C2)C(=O)N3CCNCC3
• InChI Key: OBWNKFAHYIGNHE-UHFFFAOYSA-N
• Boiling Point: 471.1ºC at 760 mmHg
• Flash Point: 238.7ºC
• Density: 1.13g/cm³
• Exact Mass: 316.19600
• H-Bond Acceptor: 4
• H-Bond Donor: 1

Synthetic Use

Downstream Synthesis Route 1

• 1171043-64-3
• 864754-07-4

• 1171040-58-6

Reference: [1]Patent: WO2009/87212,2009,A2 .Location in patent: Page/Page column 51; 95-96

Downstream Synthesis Route 2

• 1171039-42-1
• 864754-07-4

• 1171040-16-6

Reference: [1]Patent: WO2009/87212,2009,A2 .Location in patent: Page/Page column 46; 89-90

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