Ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate

Base Information

• Chemical Name: Ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate
• CAS No.: 141333-27-9
• Molecular Formula: C14H18 O5
• Molecular Weight: 266.294
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID30371558
• Wikidata: Q82158920
• Mol file: 141333-27-9.mol

Synonyms:ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate;141333-27-9;Butanoic acid, 4-(4-formyl-2-methoxyphenoxy)-, ethyl ester;SCHEMBL7367306;DTXSID30371558;YJRYCFVLCSZEAG-UHFFFAOYSA-N;AKOS008210434;FT-0626044;4-(4-Formyl-2-methoxyphenoxy)butanoic acid, ethyl ester;4- (4-Formyl-2-methoxyphenoxy)butanoic acid, ethyl ester

Chemical Property of Ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate

Chemical Property:

• Vapor Pressure: 6.76E-07mmHg at 25°C
• Refractive Index: 1.518
• Boiling Point: 408.9°C at 760 mmHg
• Flash Point: 219.6°C
• PSA: 61.83000
• Density: 1.132g/cm³
• LogP: 2.22980
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 266.11542367
• Heavy Atom Count: 19
• Complexity: 279

Purity/Quality:

98%Min ^*data from raw suppliers

3-METHOXY-4-[3-(CARBETHOXY)PROPYLOXY]BENZALDEHYDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CCCOC1=C(C=C(C=C1)C=O)OC

Technology Process of Ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate

There total 3 articles about Ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate 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: 99.0%

Ethyl 4-bromobutyrate (2969-81-5) + vanillin (121-33-5,8014-42-4) → ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate (141333-27-9)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 80 ℃; for 48h; Inert atmosphere;

DOI:10.1016/j.bmc.2012.05.011

Reference yield: 66.0%

→ ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate (141333-27-9)

Guidance literature:

With 1,8-diazabicyclo[5.4.0]undec-7-ene; In acetonitrile; at 80 ℃; for 24h;

Reference yield:

isovanillin (621-59-0) + Ethyl 4-bromobutyrate (2969-81-5) → ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate (141333-27-9)

Guidance literature:

upstream raw materials:

Ethyl 4-bromobutyrate

vanillin

isovanillin

Downstream raw materials:

4-(4-(hydroxymethyl)-2-methoxy-5-nitrophenoxy)butanoic acid

4-(4-(acryloyloxymethyl)-2-methoxy-5-nitrophenoxy)butanoic acid

4-(4-formyl-2-methoxy-5-nitrophenoxy)butanoic acid