Benzoic acid, 3,4-dimethyl-, ethyl ester

Base Information

Chemical Name:Benzoic acid, 3,4-dimethyl-, ethyl ester
CAS No.:33499-44-4
Molecular Formula:C11H14O2
Molecular Weight:178.231
Hs Code.:2916399090
European Community (EC) Number:654-200-3
DSSTox Substance ID:DTXSID70187135
Wikidata:Q83058690
Mol file:33499-44-4.mol

Synonyms:ethyl 3,4-dimethylbenzoate;33499-44-4;Benzoic acid, 3,4-dimethyl-, ethyl ester;3,4-dimethyl-benzoic acid ethyl ester;starbld0030509;SCHEMBL571193;DTXSID70187135;MFCD00026826;AKOS004911129;CS-0361505

Suppliers and Price of Benzoic acid, 3,4-dimethyl-, ethyl ester

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

TRC
ETHYL 3,4-DIMETHYLBENZOATE
500mg
$ 200.00

TRC
ETHYL 3,4-DIMETHYLBENZOATE
100mg
$ 45.00

Sigma-Aldrich
ETHYL 3,4-DIMETHYLBENZOATE Aldrich
1g
$ 33.40

Rieke Metals
3,4-Dimethyl-benzoicacidethylester
5g
$ 1728.00

Rieke Metals
3,4-Dimethyl-benzoicacidethylester
1g
$ 661.00

American Custom Chemicals Corporation
ETHYL 3,4-DIMETHYLBENZOATE 95.00%
5MG
$ 504.91

Total 6 raw suppliers

Chemical Property of Benzoic acid, 3,4-dimethyl-, ethyl ester

Chemical Property:

Vapor Pressure:0.0111mmHg at 25°C
Boiling Point:262.2°Cat760mmHg
Flash Point:116°C
PSA：26.30000
Density:1.01g/cm³
LogP:2.48010
XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:178.099379685
Heavy Atom Count:13
Complexity:177

Purity/Quality:

98% ^*data from raw suppliers

ETHYL 3,4-DIMETHYLBENZOATE ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Benzoic acid, 3,4-dimethyl-, ethyl ester

There total 7 articles about Benzoic acid, 3,4-dimethyl-, ethyl ester 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%

: 64-17-5
ethanol

: 619-04-5
3,4-dimethylbenzoic acid

: 33499-44-4
ethyl 3,4-dimethylbenzoate

Guidance literature:: With sulfuric acid; for 3h; Heating;
DOI:10.1248/cpb.40.1047

Reference yield: 80.0%

: 583-71-1
4-bromo-o-xylene

: 95-92-1
oxalic acid diethyl ester

: 33499-44-4
ethyl 3,4-dimethylbenzoate

Guidance literature:: With dmap; bis-triphenylphosphine-palladium(II) chloride; In ethanol; at 140 ℃; for 0.333333h; Microwave irradiation;
DOI:10.1002/adsc.201700307

Reference yield: 56.0%

: 615-60-1
4-chloro-1,2-dimethylbenzene

: 109-94-4
formic acid ethyl ester

: 33499-44-4
ethyl 3,4-dimethylbenzoate

Guidance literature:: With palladium diacetate; 1,8-diazabicyclo[5.4.0]undec-7-ene; catacxium A; In acetonitrile; at 140 ℃; for 16h; Inert atmosphere;
DOI:10.1002/adsc.201000047