Ethyl 2-hydroxy-5-methoxybenzoate

Base Information

• Chemical Name: Ethyl 2-hydroxy-5-methoxybenzoate
• CAS No.: 22775-40-2
• Molecular Formula: C10H12O4
• Molecular Weight: 196.203
• Hs Code.: 2918990090
• European Community (EC) Number: 245-214-7
• UNII: QQ4D5D784Y
• DSSTox Substance ID: DTXSID50177317
• Nikkaji Number: J48.323K
• Wikidata: Q27287441
• Mol file: 22775-40-2.mol

Synonyms:ethyl-5-methoxysalicylate

Chemical Property of Ethyl 2-hydroxy-5-methoxybenzoate

Chemical Property:

• Vapor Pressure: 0.000864mmHg at 25°C
• Refractive Index: 1.528
• Boiling Point: 295.5 °C at 760 mmHg
• Flash Point: 112.9 °C
• PSA: 55.76000
• Density: 1.18 g/cm³
• LogP: 1.57750
• Storage Temp.: 2-8°C
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 196.07355886
• Heavy Atom Count: 14
• Complexity: 193

Purity/Quality:

98% ^*data from raw suppliers

Ethyl2-hydroxy-5-methoxybenzoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=C(C=CC(=C1)OC)O

Technology Process of Ethyl 2-hydroxy-5-methoxybenzoate

There total 11 articles about Ethyl 2-hydroxy-5-methoxybenzoate 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: 85.1%

→ ethyl 2-hydroxy-5-methoxybenzoate (22775-40-2)

Guidance literature:

Reference yield: 55.0%

ethyl 3-methoxybenzoate (10259-22-0) → ethyl 2-hydroxy-3-methoxybenzoate (35030-98-9) + ethyl 2-hydroxy-5-methoxybenzoate (22775-40-2)

Guidance literature:

With dipotassium peroxodisulfate; [ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂; trifluoroacetic acid; trifluoroacetic anhydride; at 80 ℃; for 9.5h;

DOI:10.1021/ol301104n

Reference yield: 40.0%

4-methylbenzoic acid ethyl ester (94-08-6) → ethyl 2-hydroxy-3-methoxybenzoate (35030-98-9) + ethyl 2-hydroxy-5-methoxybenzoate (22775-40-2)

Guidance literature:

With dipotassium peroxodisulfate; palladium diacetate; trifluoroacetic acid; trifluoroacetic anhydride; at 60 ℃; for 5h; regioselective reaction; Sealed tube;

DOI:10.1002/anie.201207458

upstream raw materials:

ethyl 4-methoxyphenyl carbonate

4-methoxy-phenol

5-methoxysalicylic acid

ethyl iodide

Downstream raw materials:

3-(2-carbethoxy-4-methoxyphenoxy)thiophene

methoxy-4 (carbethoxy-2 phenoxy)-acetate de methyle

3-(2-carboxy-4-methoxyphenoxy)thiophene

ethyl 2-ethoxycarbonylmethoxy-5-methoxy benzoate

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