BENZOIC ACID, 3-CYANO-2-METHOXY-, METHYL ESTER

Base Information

• Chemical Name: BENZOIC ACID, 3-CYANO-2-METHOXY-, METHYL ESTER
• CAS No.: 406938-72-5
• Molecular Formula: C8H6ClNO4
• Molecular Weight: 191.186
• Hs Code.: 2926909090
• Mol file: 406938-72-5.mol

Synonyms:Methyl 3-cyano-2-methoxybenzoate;

Chemical Property of BENZOIC ACID, 3-CYANO-2-METHOXY-, METHYL ESTER

Chemical Property:

• Boiling Point: 329.981 °C at 760 mmHg
• Flash Point: 143.729 °C
• PSA: 59.32000
• Density: 1.206 g/cm³
• LogP: 1.35348
• Storage Temp.: 2-8°C

Purity/Quality:

99% ^*data from raw suppliers

Methyl3-cyano-2-methoxybenzoate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of BENZOIC ACID, 3-CYANO-2-METHOXY-, METHYL ESTER

There total 4 articles about BENZOIC ACID, 3-CYANO-2-METHOXY-, METHYL ESTER 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: 10.0%

methyl 2,3-dimethoxybenzoate (2150-42-7) + 2-hydroxy-2-methylpropanenitrile (75-86-5) → methyl 3-cyano-2-methoxybenzoate (406938-72-5)

Guidance literature:

With 3,6‐di‐tert‐butyl‐9‐mesityl‐10‐phenylacridin‐10‐ium tetrafluoroborate; sodium hydrogencarbonate; In 1,2-dichloro-ethane; at 26 ℃; for 18h; Inert atmosphere; Sealed tube; Irradiation;

DOI:10.1021/acs.orglett.9b02678

Reference yield:

3-cyano-2-hydroxybenzoic acid (67127-84-8) + dimethyl sulfate (77-78-1) → methyl 3-cyano-2-methoxybenzoate (406938-72-5)

Guidance literature:

With potassium carbonate; In ethyl acetate; acetone;

Reference yield:

C9H7NO3 (1032614-92-8) + methyl iodide (74-88-4) → methyl 3-cyano-2-methoxybenzoate (406938-72-5)

Guidance literature:

C₉H₇NO₃; With sodium hydride; In N,N-dimethyl-formamide;

methyl iodide; In N,N-dimethyl-formamide; at 50 ℃; for 16h; Product distribution / selectivity;

upstream raw materials:

3-cyano-2-hydroxybenzoic acid

dimethyl sulfate

C₉H₇NO₃

methyl iodide

Downstream raw materials:

C₁₀H₁₂N₂O₄

Refernces

• 1、 -. "Hydroxylated 1,2,4-oxadiazole benzoic acid compounds, composistions thereof and the use for nonsense suppression". Page/Page column 20. . Retrieved 2008/12/06.