3-(1,1,2,2,2-Pentafluoroethoxy)benzoic acid

Base Information

Chemical Name:3-(1,1,2,2,2-Pentafluoroethoxy)benzoic acid
CAS No.:123876-27-7
Molecular Formula:C₉H₅F₅O₃
Molecular Weight:256.129
Hs Code.:
European Community (EC) Number:895-829-5

Synonyms:3-(1,1,2,2,2-pentafluoroethoxy)benzoic acid;SCHEMBL10559975;BCGBIUZYGBHRRB-UHFFFAOYSA-N;EN300-27702957;Z3681419513;123876-27-7

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 3-(1,1,2,2,2-Pentafluoroethoxy)benzoic acid

Chemical Property:

XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:256.01588483
Heavy Atom Count:17
Complexity:289

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of 3-(1,1,2,2,2-Pentafluoroethoxy)benzoic acid

There total 2 articles about 3-(1,1,2,2,2-Pentafluoroethoxy)benzoic acid 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: 61.0%

: 57076-57-0
3-pentafluoroethoxy-toluene

: 123876-27-7
3-pentafluoroethyloxy-benzoic acid

Guidance literature:: With potassium permanganate;
DOI:10.2533/000942904777678226

Reference yield:

: 1736-09-0
3-methylphenyl trifluoroacetate

: 123876-27-7
3-pentafluoroethyloxy-benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 82 percent / SF₄; HF / 15 h / 25 °C / 60004.8 Torr

2: 61 percent / KMnO₄

With potassium permanganate; sulfur tetrafluoride; hydrogen fluoride;
DOI:10.2533/000942904777678226