Methyl 4-(2-fluoroethyl)benzoate

Base Information

Chemical Name:Methyl 4-(2-fluoroethyl)benzoate
CAS No.:819883-83-5
Molecular Formula:C10H11FO2
Molecular Weight:182.195
Hs Code.:
DSSTox Substance ID:DTXSID90709696
Wikidata:Q82644797

Synonyms:Methyl 4-(2-fluoroethyl)benzoate;819883-83-5;SCHEMBL8759817;DTXSID90709696

Suppliers and Price of Methyl 4-(2-fluoroethyl)benzoate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 1 raw suppliers

Chemical Property of Methyl 4-(2-fluoroethyl)benzoate

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:182.07430775
Heavy Atom Count:13
Complexity:162

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(=O)C1=CC=C(C=C1)CCF

Technology Process of Methyl 4-(2-fluoroethyl)benzoate

There total 4 articles about Methyl 4-(2-fluoroethyl)benzoate 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: 91.0%

: 46190-45-8
4-(2-hydroxyethyl)benzoic acid methyl ester

: 819883-83-5
4-(2-fluoroethyl)benzoic acid methyl ester

Guidance literature:: With 4,4'-diaminostilbene-2,2'-disulfonic acid; In dichloromethane;
DOI:10.1016/j.bmc.2004.09.054

Reference yield: 83.0%

: 762-51-6
1-fluoro-2-iodoethane

: 99768-12-4
4-methoxycarbonylphenylboronic acid

: 819883-83-5
4-(2-fluoroethyl)benzoic acid methyl ester

Guidance literature:: With potassium phosphate; 4,4'-Dimethoxy-2,2'-bipyridin; nickel dibromide; In diethylene glycol dimethyl ether; at 80 ℃; for 24h; Inert atmosphere; Sealed tube;

Reference yield:

: 1075-49-6
4-ethenylbenzoic acid

: 819883-83-5
4-(2-fluoroethyl)benzoic acid methyl ester

Guidance literature:: Multi-step reaction with 3 steps

1.1: 76 percent / triethylamine / CH₂Cl₂ / 20 h / 20 °C

2.1: BH₃ / tetrahydrofuran / 2 h

2.2: 54 percent / NaOH; H₂O₂ / H₂O / 1 h

3.1: 91 percent / DAST / CH₂Cl₂

With borane; triethylamine; 4,4'-diaminostilbene-2,2'-disulfonic acid; In tetrahydrofuran; dichloromethane;
DOI:10.1016/j.bmc.2004.09.054