7-Chloroquinoline-4-boronicacidpinacolester

• CAS: 871125-83-6
• Catalog Number: ACM871125836
• Category: Boronic Esters
• Molecular Weight: 289.5683
• Molecular Formula: C₁₅H₁₇BClNO₂
• Synonyms: 871125-83-6, 7-Chloroquinoline-4-boronic acid pinacol ester, 7-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline, SureCN7915830, 658596_ALDRICH, CTK5F7826, MolPort-001-768-799, ANW-42361, OR4309, AKOS015950162, AG-H-51321, MB05034, AK-85624, KB-46326, B-4582, 7-Chloroquinoline-4-boronic acid, pinacol ester, 7-Chloroquinoline-4-boronic acid, pinacol ester,, (7-CHLOROQUINOLIN-4-YL)BORONIC ACID PINACOL ESTER, 7-chloro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline, Quinoline,7-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
• IUPAC Name: 7-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=C3C=CC(=CC3=NC=C2)Cl
• InChI Key: GZDUYRAAWRRVEY-UHFFFAOYSA-N
• Boiling Point: 415ºC at 760 mmHg
• Melting Point: 81-87ºC
• Flash Point: 204.8ºC
• Density: 1.19g/cm³
• Exact Mass: 289.10400
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 3
• H-Bond Donor: 0
• Safety Description: 26-36

Synthetic Use

Downstream Synthesis Route 1

• 871125-83-6
• 1007126-12-6

• 1007126-13-7

Reference: [1]Current Patent Assignee: TAKEDA PHARMACEUTICAL COMPANY LIMITED - US2008/51404, 2008, A1
Location in patent: Page/Page column 118-119

Downstream Synthesis Route 2

• 885675-76-3
• 871125-83-6

• 1257296-01-7

Reference: [1]Current Patent Assignee: ROCHE HOLDING AG - WO2010/138589, 2010, A1
Location in patent: Page/Page column 390-391

Downstream Synthesis Route 3

• 871125-83-6
• 37465-31-9

• 1426661-72-4

Reference: [1]Bianchini, Giulio; Scarso, Alessandro; Chiminazzo, Andrea; Sperni, Laura; Strukul, Giorgio
[Green Chemistry, 2013, vol. 15, # 3, p. 656 - 662]

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