4-(Chloromethyl)-3,5-dimethylphenyl ethyl carbonate

Base Information

Chemical Name:4-(Chloromethyl)-3,5-dimethylphenyl ethyl carbonate
CAS No.:54373-50-1
Molecular Formula:C12H15ClO3
Molecular Weight:242.702
Hs Code.:
DSSTox Substance ID:DTXSID30506000
Wikidata:Q82361521

Synonyms:54373-50-1;4-(Chloromethyl)-3,5-dimethylphenyl ethyl carbonate;SCHEMBL6304969;DTXSID30506000;Carbonic acid 4-chloromethyl-3,5-dimethyl-phenyl ester ethyl ester

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Chemical Property of 4-(Chloromethyl)-3,5-dimethylphenyl ethyl carbonate

Chemical Property:

PSA：35.53000
LogP:3.57750
XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:242.0709720
Heavy Atom Count:16
Complexity:220

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)OC1=CC(=C(C(=C1)C)CCl)C

Technology Process of 4-(Chloromethyl)-3,5-dimethylphenyl ethyl carbonate

There total 4 articles about 4-(Chloromethyl)-3,5-dimethylphenyl ethyl carbonate 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%

: 109-87-5
Dimethoxymethane

: 26177-58-2
3,5-Dimethylphenyl ethyl carbonate

: 54373-50-1
O-ethoxycarbonyl-3,5-dimethyl-4-chloromethylphenol

Guidance literature:: Dimethoxymethane; With chlorosulfonic acid; zinc(II) iodide; In dichloromethane; at -10 ℃; for 0.5h;

3,5-Dimethylphenyl ethyl carbonate; In dichloromethane; at 5 - 10 ℃; for 0.5h; Reagent/catalyst;
DOI:10.1177/1747519819836488

Reference yield:

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 26177-58-2
3,5-Dimethylphenyl ethyl carbonate

: 54373-50-1
O-ethoxycarbonyl-3,5-dimethyl-4-chloromethylphenol

Guidance literature:: With hydrogenchloride;

Reference yield:

: 108-68-9,50356-23-5
3,5-Dimethylphenol

: 54373-50-1
O-ethoxycarbonyl-3,5-dimethyl-4-chloromethylphenol

Guidance literature:: Multi-step reaction with 2 steps

1: 92 percent / pyridine / benzene / 24 h / Heating

2: 52 percent / HCl-gas, conc. HCl acid / 1) 0.5 deg C, 1 h; 2) 25 deg C, 3 h

With pyridine; hydrogenchloride; In benzene;