1-chloro-5-fluoroisoquinoline

Base Information

• Chemical Name: 1-chloro-5-fluoroisoquinoline
• CAS No.: 435278-02-7
• Molecular Formula: C9H5ClFN
• Molecular Weight: 181.59
• Hs Code.: 2933499090
• Mol file: 435278-02-7.mol

Synonyms:1-chloro-5-fluoroisoquinoline

Chemical Property of 1-chloro-5-fluoroisoquinoline

Chemical Property:

• Boiling Point: 295.6±20.0 °C(Predicted)
• PKA: 1.09±0.43(Predicted)
• PSA: 12.89000
• Density: 1.366±0.06 g/cm3(Predicted)
• LogP: 3.02730
• Storage Temp.: 2-8°C

Purity/Quality:

NLT 98% ^*data from raw suppliers

1-Chloro-5-fluoroisoquinoline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 1-chloro-5-fluoroisoquinoline

There total 2 articles about 1-chloro-5-fluoroisoquinoline which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

→ 1-chloro-5-fluoroisoquinoline (435278-02-7)

Guidance literature:

Reference yield:

5-fluoroisoquinolin-1(2H)-one (410086-25-8) → 1-chloro-5-fluoroisoquinoline (435278-02-7)

Guidance literature:

With trichlorophosphate; at 80 ℃; for 2h;

Reference yield:

1-chloro-5-fluoroisoquinoline (435278-02-7) → 5-fluoro-1,3-dichloroisoquinoline (1259223-98-7)

Guidance literature:

Multi-step reaction with 2 steps

1.1: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 18 h / 20 °C / Inert atmosphere

1.2: 1 h / 20 °C / Inert atmosphere

2.1: trichlorophosphate / neat (no solvent) / 3 h / 80 °C / Inert atmosphere

With 3-chloro-benzenecarboperoxoic acid; trichlorophosphate; In dichloromethane;

DOI:10.1021/jm301796k

upstream raw materials:

5-fluoroisoquinolin-1(2H)-one

Downstream raw materials:

5-fluoro-1,3-dichloroisoquinoline

Refernces

• 1、 -. "Hepatitis C Virus Inhibitors". Page/Page column 137-138. . Retrieved 2008/12/05.