3-chloro-5-methoxybenzonitrile

Base Information

• Chemical Name: 3-chloro-5-methoxybenzonitrile
• CAS No.: 473923-96-5
• Molecular Formula: C8H6ClNO
• Molecular Weight: 167.595
• Hs Code.: 2926909090
• Mol file: 473923-96-5.mol

Synonyms:3-chloro-5-(methyloxy)benzonitrile;Benzonitrile,3-chloro-5-methoxy;5-chloro-3-methoxy-benzonitrile;3-chloro-5-methoxybenzenecarbonitrile;3-Chloro-5-methoxy-benzonitrile;

Chemical Property of 3-chloro-5-methoxybenzonitrile

Chemical Property:

• Boiling Point: 241.0±25.0 °C(Predicted)
• PSA: 33.02000
• Density: 1.25±0.1 g/cm3(Predicted)
• LogP: 2.22028
• Storage Temp.: 2-8°C

Purity/Quality:

99% ^*data from raw suppliers

3-Chloro-5-methoxybenzonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-chloro-5-methoxybenzonitrile

There total 6 articles about 3-chloro-5-methoxybenzonitrile 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: 90.0%

3,5-dichlorobenzonitrile (6575-00-4) + sodium methylate (124-41-4) → 3-chloro-5-methoxybenzonitrile (473923-96-5)

Guidance literature:

3,5-dichlorobenzonitrile; sodium methylate; In N,N-dimethyl-formamide; at 0 - 20 ℃;

With hydrogenchloride; In water; N,N-dimethyl-formamide; at 20 ℃; Cooling with ice;

Reference yield:

3-chloro-5-hydroxybenzonitrile (473923-97-6) + methyl iodide (74-88-4) → 3-chloro-5-methoxybenzonitrile (473923-96-5)

Guidance literature:

With potassium carbonate; In acetone; at 70 ℃;

Reference yield:

zinc(II) cyanide (557-21-1) + 1-bromo-3-chloro-5-methoxybenzene (174913-12-3) → 3-chloro-5-methoxybenzonitrile (473923-96-5)

Guidance literature:

tetrakis(triphenylphosphine) palladium⁽⁰⁾; In DMF (N,N-dimethyl-formamide); at 20 - 100 ℃; for 14h;

upstream raw materials:

zinc(II) cyanide

1-bromo-3-chloro-5-methoxybenzene

dicyanozinc

3,5-dichlorobenzonitrile

Downstream raw materials:

3-chloro-5-hydroxybenzonitrile

C₉H₈ClN₃O

(Z)-ethyl 3-(3-(3-chloro-5-methoxyphenyl)-1H-1,2,4-triazol-1-yl)acrylate

(Z)-methyl 3-(3-(3-chloro-5-methoxyphenyl)-1H-1,2,4-triazol-1-yl)acrylate

Refernces

• 1、 -. "New Pharmaceutical Compounds". Page/Page column 17. . Retrieved 2012/12/13.
• 2、 -. "NUCLEAR TRANSPORT MODULATIORS AND USES THEREOF". Page/Page column 115-116. . Retrieved 2011/10/03.