Dimethyl 2-fluoroterephthalate

Base Information

Chemical Name:Dimethyl 2-fluoroterephthalate
CAS No.:5292-47-7
Molecular Formula:C10H9FO4
Molecular Weight:212.177
Hs Code.:29173990
European Community (EC) Number:226-135-7
DSSTox Substance ID:DTXSID10200973
Nikkaji Number:J297.982I
Mol file:5292-47-7.mol

Synonyms:Dimethyl 2-fluoroterephthalate;5292-47-7;2-fluoroterephthalic acid dimethyl ester;Dimethyl fluoroterephthalate;dimethyl 2-fluorobenzene-1,4-dicarboxylate;C10H9FO4;EINECS 226-135-7;1,4-dimethyl 2-fluorobenzene-1,4-dicarboxylate;SCHEMBL523320;1,4-Benzenedicarboxylic acid, 2-fluoro-, dimethyl ester;DTXSID10200973;C10-H9-F-O4;Dimethyl 2-fluoroterephthalate, 96%;MFCD00042266;AKOS015853284;PS-7990;2-fluoro-terephthalic acid dimethyl ester;2-Fluoroterephthalic acid, dimethyl ester;AC-25989;CS-0319889;FT-0625056;A19947;2-fluorobenzene-1,4-dicarboxylic acid dimethyl ester;Dimethyl 2-fluorobenzene-1,4-dicarboxylate

Suppliers and Price of Dimethyl 2-fluoroterephthalate

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
Dimethyl 2-fluoroterephthalate
100mg
$ 60.00

SynQuest Laboratories
Dimethyl 2-fluoroterephthalate 98%
5 g
$ 245.00

SynQuest Laboratories
Dimethyl 2-fluoroterephthalate 98%
1 g
$ 65.00

Sigma-Aldrich
Dimethyl 2-fluoroterephthalate 96%
1g
$ 81.60

Matrix Scientific
Dimethyl fluoroterephthalate 97%
1g
$ 77.00

Matrix Scientific
Dimethyl fluoroterephthalate 97%
5g
$ 224.00

Crysdot
Dimethyl 2-fluoroterephthalate 95+%
25g
$ 480.00

Crysdot
Dimethyl 2-fluoroterephthalate 95+%
5g
$ 137.00

Biosynth Carbosynth
Dimethyl 2-fluoroterephthalate
5 g
$ 225.00

Biosynth Carbosynth
Dimethyl 2-fluoroterephthalate
2 g
$ 100.00

Total 38 raw suppliers

Chemical Property of Dimethyl 2-fluoroterephthalate

Chemical Property:

Appearance/Colour:white to light yellow crystal powder
Vapor Pressure:0.00119mmHg at 25°C
Melting Point:83-85 °C(lit.)
Refractive Index:1.499
Boiling Point:299.4 °C at 760 mmHg
Flash Point:130.6 °C
PSA：52.60000
Density:1.252g/cm³
LogP:1.39890
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:212.04848693
Heavy Atom Count:15
Complexity:254

Purity/Quality:

97% ^*data from raw suppliers

Dimethyl 2-fluoroterephthalate ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:COC(=O)C1=CC(=C(C=C1)C(=O)OC)F

Technology Process of Dimethyl 2-fluoroterephthalate

There total 4 articles about Dimethyl 2-fluoroterephthalate 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%

: 67-56-1
methanol

: 3906-87-4
2-fluoro-1,4-benzenedicarboxylic acid

: 5292-47-7
1,4-dimethyl 2-fluorobenzene-1,4-dicarboxylate

Guidance literature:: With sulfuric acid; for 48h; Reflux;
DOI:10.1021/acs.inorgchem.7b02391

Reference yield: 64.0%

: 67-56-1
methanol

: 201230-82-2
carbon monoxide

: 348-59-4
1,4-dichloro-2-fluorobenzene

: 5292-47-7
1,4-dimethyl 2-fluorobenzene-1,4-dicarboxylate

: 148893-72-5
4-chloro-2-fluorobenzoic acid methyl ester

Guidance literature:: carbon monoxide; 1,4-dichloro-2-fluorobenzene; With potassium carbonate; In methanol; for 0.5h; under 760.051 Torr;

methanol; With potassium tetracarbonylcobaltate; at 61 ℃; chemoselective reaction; Further stages;
DOI:10.1016/j.jfluchem.2009.10.010

Reference yield:

: 350-28-7
3-fluoro-4-methyl-benzoic acid

: 5292-47-7
1,4-dimethyl 2-fluorobenzene-1,4-dicarboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: potassium permanganate; potassium hydroxide / water / Reflux

2: sulfuric acid / 48 h / Reflux

With potassium permanganate; sulfuric acid; potassium hydroxide; In water;
DOI:10.1021/acs.inorgchem.7b02391