Ethyl 4-chloro-2-methylbenzoate

Base Information

• Chemical Name: Ethyl 4-chloro-2-methylbenzoate
• CAS No.: 15393-58-5
• Molecular Formula: C10H11ClO2
• Molecular Weight: 198.649
• Hs Code.: 2916399090
• DSSTox Substance ID: DTXSID901022933
• Mol file: 15393-58-5.mol

Synonyms:Ethyl 4-chloro-2-methylbenzoate;15393-58-5;4-Chloro-2-methylbenzoic acid ethyl ester;ethyl 5-chloro-o-toluate;Benzoic acid, 4-chloro-2-methyl-, ethyl ester;Ethyl4-chloro-2-methylbenzoate;SCHEMBL5248889;NLTONRXIPNPAGV-UHFFFAOYSA-N;DTXSID901022933;MFCD11554963;AKOS006319040;BS-50707;CS-0199327;E78635

Chemical Property of Ethyl 4-chloro-2-methylbenzoate

Chemical Property:

• PSA: 26.30000
• LogP: 2.82510
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 198.0447573
• Heavy Atom Count: 13
• Complexity: 182

Purity/Quality:

99% ^*data from raw suppliers

4-Chloro-2-methylbenzoicacidethylester ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=C(C=C(C=C1)Cl)C

Technology Process of Ethyl 4-chloro-2-methylbenzoate

There total 10 articles about Ethyl 4-chloro-2-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: 95.0%

4-chloro-2-methylbenzoic acid (7499-07-2) + orthoformic acid triethyl ester (122-51-0) → 4-chloro-2-methyl-benzoic acid ethyl ester (15393-58-5)

Guidance literature:

With ethanol; sulfuric acid;

Reference yield: 83.4%

4-chloro-2-methylbenzoic acid (7499-07-2) + ethyl iodide (75-03-6) → 4-chloro-2-methyl-benzoic acid ethyl ester (15393-58-5)

Guidance literature:

4-chloro-2-methylbenzoic acid; With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 0.5h;

ethyl iodide; In N,N-dimethyl-formamide;

Reference yield:

4-chloro-2-methylbenzoic acid (7499-07-2) → 4-chloro-2-methyl-benzoic acid ethyl ester (15393-58-5)

Guidance literature:

upstream raw materials:

ethyl nitrite

ethanol

4-chloro-2-methylbenzoic acid

1-chloro-3-methylbenzene

Downstream raw materials:

(4-Chloro-2-methylphenyl)acetonitrile

4-chloro-2-(phenoxymethyl)benzoic acid

4-(2-carboxy-5-chlorobenzyloxy)phenylacetic acid

2-(4-chloro-2-methylphenyl)-3-hydroxypropanenitrile