Butyl 4-(1,1-dimethylethyl)benzoate

Base Information

Chemical Name:Butyl 4-(1,1-dimethylethyl)benzoate
CAS No.:94134-32-4
Molecular Formula:C15H22 O2
Molecular Weight:234.338
Hs Code.:
European Community (EC) Number:302-800-8
DSSTox Substance ID:DTXSID30916367
Nikkaji Number:J33.489H
Wikidata:Q82887574
Mol file:94134-32-4.mol

Synonyms:Butyl 4-(1,1-dimethylethyl)benzoate;EINECS 302-800-8;94134-32-4;butyl 4-tert-butylbenzoate;SCHEMBL12251325;DTXSID30916367;BMSNGGLCKZGIEY-UHFFFAOYSA-N;p-tert-Butylbenzoic acid butyl ester;Benzoic acid, 4-tert-butyl-, butyl ester

Suppliers and Price of Butyl 4-(1,1-dimethylethyl)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
Packaging
price

Total 6 raw suppliers

Chemical Property of Butyl 4-(1,1-dimethylethyl)benzoate

Chemical Property:

Vapor Pressure:0.00053mmHg at 25°C
Boiling Point:312.4°Cat760mmHg
Flash Point:127.5°C
PSA：26.30000
Density:0.962g/cm³
LogP:3.94100
XLogP3:5.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:234.161979940
Heavy Atom Count:17
Complexity:232

Purity/Quality:: 98%Min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCOC(=O)C1=CC=C(C=C1)C(C)(C)C

Technology Process of Butyl 4-(1,1-dimethylethyl)benzoate

There total 8 articles about Butyl 4-(1,1-dimethylethyl)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: 80.0%

: 60561-82-2
1-(4-(tert-butyl)phenyl)-2-methylpropan-1-one

: 26501-54-2
tetrabutylammonium nitrite

: 94134-32-4
4-tert-butylbenzoic acid butyl ester

Guidance literature:: With copper(l) iodide; 1,10-Phenanthroline; In o-xylene; at 150 ℃; for 6h; Inert atmosphere;
DOI:10.1021/ol800576w

Reference yield:

: 201230-82-2
carbon monoxide

: 7598-28-9
4-tert-butylphenyltosylate

: 71-36-3
butan-1-ol

: 94134-32-4
4-tert-butylbenzoic acid butyl ester

Guidance literature:: With 4 A molecular sieve; potassium carbonate; palladium diacetate; In toluene; at 100 ℃; for 15h; under 760.051 Torr;
DOI:10.1021/ja711449e

Reference yield:

: 201230-82-2
carbon monoxide

: 59970-38-6
4-tert-butylphenyl mesylate

: 71-36-3
butan-1-ol

: 94134-32-4
4-tert-butylbenzoic acid butyl ester

Guidance literature:: With 4 A molecular sieve; potassium carbonate; palladium diacetate; In toluene; at 100 ℃; for 15h; under 760.051 Torr;
DOI:10.1021/ja711449e