(2-methylphenyl) 4-nitrobenzoate

Base Information

• Chemical Name: (2-methylphenyl) 4-nitrobenzoate
• CAS No.: 5421-45-4
• Molecular Formula: C14H11NO4
• Molecular Weight: 257.246
• Mol file: 5421-45-4.mol

Synonyms:Benzoic acid, 4-nitro-, 2-methylphenyl ester;4-Nitro-benzoesaeure-o-tolylester;p-nitrobenzoate d'o-tolyle;Benzoic acid,p-nitro-,o-tolyl ester;2-methylphenyl 4-nitrobenzoate;4-nitro-benzoic acid o-tolyl ester;4-nitro-benzoic acid,2-methylphenyl ester;

Chemical Property of (2-methylphenyl) 4-nitrobenzoate

Chemical Property:

• Vapor Pressure: 1.83E-08mmHg at 25°C
• Boiling Point: 454.9°C at 760 mmHg
• Flash Point: 209.9°C
• PSA: 72.12000
• Density: 1.28g/cm³
• LogP: 3.64560

Purity/Quality:

2-methylphenyl4-nitrobenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of (2-methylphenyl) 4-nitrobenzoate

There total 2 articles about (2-methylphenyl) 4-nitrobenzoate 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: 93.0%

4-nitro-benzoyl chloride (122-04-3) + ortho-cresol (95-48-7,77504-84-8) → 2-methylphenyl 4-nitrobenzoate (5421-45-4)

Guidance literature:

at 130 ℃; for 3h;

DOI:10.1016/S0040-4020(01)92357-9

Reference yield: 90.0%

ortho-cresol (95-48-7,77504-84-8) + 4-nitro-benzoic acid (62-23-7) → 2-methylphenyl 4-nitrobenzoate (5421-45-4)

Guidance literature:

With 5,5'-dimethyl-3,3′-azoisooxazole; triphenylphosphine; In acetonitrile; at 80 ℃; for 8.5h;

DOI:10.1039/c004357e

Reference yield: 87.0%

2-methylphenyl 4-nitrobenzoate (5421-45-4) → p-nitrobenzoate de bromomethyl-2 phenyle (80645-51-8)

Guidance literature:

With N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile); In tetrachloromethane; at 85 ℃; for 6h; Inert atmosphere;

DOI:10.1016/j.tetlet.2020.151634

upstream raw materials:

4-nitro-benzoyl chloride

ortho-cresol

4-nitro-benzoic acid

Downstream raw materials:

p-nitrobenzoate de bromomethyl-2 phenyle

2-(4-nitrophenyl)-1-benzofurane

bromure de p-nitrobenzoyloxy-2 benzyltriphenylphosphonium