Ethyl 4-ethoxy-3,5-dimethoxybenzoate

Base Information

• Chemical Name: Ethyl 4-ethoxy-3,5-dimethoxybenzoate
• CAS No.: 75332-45-5
• Molecular Formula: C13H18O5
• Molecular Weight: 254.283
• DSSTox Substance ID: DTXSID40346757
• Nikkaji Number: J144.299F
• Wikidata: Q82119986
• Mol file: 75332-45-5.mol

Synonyms:Ethyl 4-ethoxy-3,5-dimethoxybenzoate;Benzoic acid, 4-ethoxy-3,5-dimethoxy-, ethyl ester;75332-45-5;DTXSID40346757;Ethyl 4-ethoxy-3,5-dimethoxybenzoate #;4-Ethoxy-3,5-dimethoxybenzoic acid ethyl ester

Chemical Property of Ethyl 4-ethoxy-3,5-dimethoxybenzoate

Chemical Property:

• PSA: 53.99000
• LogP: 2.27920
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 254.11542367
• Heavy Atom Count: 18
• Complexity: 242

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=C(C=C(C=C1OC)C(=O)OCC)OC

Technology Process of Ethyl 4-ethoxy-3,5-dimethoxybenzoate

There total 5 articles about Ethyl 4-ethoxy-3,5-dimethoxybenzoate 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: 62.0%

3,5-dimethoxy-4-hydroxybenzoic acid (530-57-4) + ethyl iodide (75-03-6) → ethyl 3,5-dimethoxy-4-ethoxybenzoate (75332-45-5)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 18h;

Reference yield:

3,5-dimethoxy-4-hydroxybenzoic acid (530-57-4) → ethyl 3,5-dimethoxy-4-ethoxybenzoate (75332-45-5)

Guidance literature:

Multi-step reaction with 2 steps

1: NaOH-solution

2: hydrogen chloride

With hydrogenchloride; sodium hydroxide;

Reference yield:

Eudesmic acid (118-41-2) → ethyl 3,5-dimethoxy-4-ethoxybenzoate (75332-45-5)

Guidance literature:

Multi-step reaction with 3 steps

1: fuming sulfuric acid / 33 - 40 °C

2: NaOH-solution

3: hydrogen chloride

With hydrogenchloride; sodium hydroxide; sulfuric acid;

upstream raw materials:

3,5-dimethoxy-4-ethoxybenzoic acid

ethanol

Diazoethan

3,5-dimethoxy-4-hydroxybenzoic acid

Downstream raw materials:

3,5-dimethoxy-4-ethoxybenzyl alcohol

3,5-dimethoxy-4-ethoxybenzoic acid

2-(4-ethoxy-3,5-dimethoxy-benzyl)-3-ethyl-6-hydroxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline

2-(4-ethoxy-3,5-dimethoxy-benzyl)-3-ethyl-6-benzyloxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline