Benzyl trichloroacetate

Base Information

Chemical Name:Benzyl trichloroacetate
CAS No.:26827-38-3
Molecular Formula:C9H7 Cl3 O2
Molecular Weight:253.512
Hs Code.:2915400090
European Community (EC) Number:248-017-4
NSC Number:50965
DSSTox Substance ID:DTXSID10181319
Nikkaji Number:J249.054D
Wikidata:Q83051927
Mol file:26827-38-3.mol

Synonyms:Benzyl trichloroacetate;benzyl 2,2,2-trichloroacetate;26827-38-3;EINECS 248-017-4;AI3-32475;Acetic acid, trichloro-, phenylmethyl ester;SCHEMBL988839;Trichloroacetic acid benzyl ester;DTXSID10181319;Trichloroacetic acid, benzyl ester;NSC50965;NSC 50965;NSC-50965;Acetic acid, trichloro-, benzyl ester

Suppliers and Price of Benzyl trichloroacetate

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
Packaging
price

Total 7 raw suppliers

Chemical Property of Benzyl trichloroacetate

Chemical Property:

Vapor Pressure:0.00288mmHg at 25°C
Boiling Point:285°Cat760mmHg
Flash Point:113.8°C
PSA：26.30000
Density:1.436g/cm³
LogP:3.10000
XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:251.951163
Heavy Atom Count:14
Complexity:195

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Benzyl trichloroacetate

There total 5 articles about Benzyl trichloroacetate 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%

: 100-51-6,185532-71-2
benzyl alcohol

: 76-03-9
trichloroacetic acid

: 26827-38-3
benzyl 2,2,2-trichloroacetate

Guidance literature:: ammonium cerium(IV) nitrate; In chloroform; at 55 - 60 ℃;
DOI:10.1039/b005908k

Reference yield: 93.0%

: 53772-44-4
benzyloxydiphenylphosphine

: 76-03-9
trichloroacetic acid

: 26827-38-3
benzyl 2,2,2-trichloroacetate

Guidance literature:: With 2,6-dimethyl-1,4-benzoquinone; In dichloromethane; at 20 ℃; for 0.5h;
DOI:10.1246/bcsj.76.1645

Reference yield:

: 100-51-6,185532-71-2
benzyl alcohol

: 26827-38-3
benzyl 2,2,2-trichloroacetate

Guidance literature:: Multi-step reaction with 2 steps

1: 55 percent / pyridine / diethyl ether / 1 h / 20 °C

2: 93 percent / 2,6-dimethyl-1,4-benzoquinone / CH₂Cl₂ / 0.5 h / 20 °C

With pyridine; 2,6-dimethyl-1,4-benzoquinone; In diethyl ether; dichloromethane;
DOI:10.1246/bcsj.76.1645