Methyl 2-cyano-3-Methylbenzoate

Base Information

• Chemical Name: Methyl 2-cyano-3-Methylbenzoate
• CAS No.: 500024-27-1
• Molecular Formula: C10H9NO2
• Molecular Weight: 175.187
• Mol file: 500024-27-1.mol

Synonyms:Methyl 2-cyano-3-Methylbenzoate;2-Cyano-3-methyl-benzoic acid methyl ester

Chemical Property of Methyl 2-cyano-3-Methylbenzoate

Chemical Property:

• Boiling Point: 316.4±30.0 °C(Predicted)
• PSA: 50.09000
• Density: 1.15±0.1 g/cm3(Predicted)
• LogP: 1.65328
• Storage Temp.: Sealed in dry,Room Temperature

Purity/Quality:

98% ^*data from raw suppliers

Methyl2-cyano-3-methylbenzoate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Methyl 2-cyano-3-Methylbenzoate

There total 8 articles about Methyl 2-cyano-3-Methylbenzoate 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: 81.0%

copper(l) cyanide + methyl 2-bromo-3-methylbenzoate (131001-86-0) → methyl 2-cyano-3-methylbenzoate (500024-27-1)

Guidance literature:

With palladium bis[bis(diphenylphosphino)ferrocene] dichloride; zinc; In N,N-dimethyl-formamide; at 130 ℃; for 4h; Inert atmosphere;

Reference yield: 43.0%

zinc(II) cyanide (557-21-1) + methyl 2-bromo-3-methylbenzoate (131001-86-0) → methyl 2-cyano-3-methylbenzoate (500024-27-1)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; In N,N-dimethyl-formamide; at 80 ℃; Inert atmosphere;

Reference yield:

methyl 2-amino-3-methylbenzoate (22223-49-0) + copper(l) cyanide → methyl 2-cyano-3-methylbenzoate (500024-27-1)

Guidance literature:

With hydrogenchloride; sodium nitrite; In water; at 0 - 5 ℃;

DOI:10.1016/j.bmcl.2009.05.054

upstream raw materials:

methyl 2-amino-3-methylbenzoate

3-methyl-2-nitrobenzoic acid

methyl 3-methyl-2-nitrobenzoate

m-Toluic acid

Downstream raw materials:

3-methylphthalic acid

Refernces

• 1、 -. "QUINAZOLINEDIONES AS TANKYRASE INHIBITORS". Page/Page column 42. . Retrieved 2014/01/07.