ETHYL 2,6-DIMETHYLBENZOATE

Base Information

• Chemical Name: ETHYL 2,6-DIMETHYLBENZOATE
• CAS No.: 36596-67-5
• Molecular Formula: C11H14O2
• Molecular Weight: 178.231
• Hs Code.: 2916399090
• Mol file: 36596-67-5.mol

Synonyms:Ethyl 2,6-dimethylbenzoate;RARECHEM AL BI 0363;Benzoic acid, 2,6-dimethyl-, ethyl ester;

Chemical Property of ETHYL 2,6-DIMETHYLBENZOATE

Chemical Property:

• Appearance/Colour: liquid
• Vapor Pressure: 0.0502mmHg at 25°C
• Refractive Index: 1.4980
• Boiling Point: 235.4 °C at 760 mmHg
• Flash Point: 95.4 °C
• PSA: 26.30000
• Density: 1.01 g/cm³
• LogP: 2.48010
• Solubility.: Difficult to mix.

Purity/Quality:

98%min ^*data from raw suppliers

Ethyl2,6-Dimethylbenzoate ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of ETHYL 2,6-DIMETHYLBENZOATE

There total 8 articles about ETHYL 2,6-DIMETHYLBENZOATE 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: 96.0%

2,6-dimethylbenzoic acid (632-46-2) + ethyl iodide (75-03-6) → 2,6-dimethylbenzoic acid ethyl ester (36596-67-5)

Guidance literature:

2,6-dimethylbenzoic acid; With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 0.833333h;

ethyl iodide; In N,N-dimethyl-formamide; at 20 ℃;

Reference yield: 95.0%

ethanol (64-17-5) + 2,6-dimethylbenzoic acid (632-46-2) → 2,6-dimethylbenzoic acid ethyl ester (36596-67-5)

Guidance literature:

With sulfuric acid; at 100 ℃; for 12h; Sealed tube;

DOI:10.1021/jacs.7b04490

Reference yield: 84.0%

chloroformic acid ethyl ester (541-41-3) + (2,6-dimethylphenyl)magnesium bromide (21450-64-6) → C11H14O3 + 2,6-dimethylbenzoic acid ethyl ester (36596-67-5)

Guidance literature:

With copper(I) bromide; lithium bromide; In tetrahydrofuran; at 20 ℃;

DOI:10.1055/s-2007-973861

upstream raw materials:

2,6-dimethylbenzoic acid

Triethyl orthoacetate

ethanol

2,6-dimethylbenzoyl chloride

Downstream raw materials:

2-bromomethyl-6-methyl-benzoic acid ethyl ester

2,6-dimethylbenzyl alcohol

ethyl 2,6-bis((3,5-bis((diphenylmethoxy)carbonyl)phenoxy)methyl)benzoate

ethyl 2,6-bis((3,5-dicarboxyphenoxy)methyl)benzoate

Refernces

• 1、 Hoque, Md Emdadul,Bisht, Ranjana,Haldar, Chabush,Chattopadhyay, Buddhadeb. "Noncovalent Interactions in Ir-Catalyzed C-H Activation: L-Shaped Ligand for Para-Selective Borylation of Aromatic Esters". supporting information. p. 7745 - 7748. Retrieved 2017/06/21.
• 2、 Trujillo, John I.,Gopalan, Aravamudan S.. "Facile esterification of sulfonic acids and carboxylic acids with triethylorthoacetate". . p. 7355 - 7358. Retrieved 2007/10/02.