Perfluorophenyl benzoate

Base Information

Chemical Name:Perfluorophenyl benzoate
CAS No.:1548-84-1
Molecular Formula:C6H5CO2C6F5
Molecular Weight:288.174
Hs Code.:2916310090
European Community (EC) Number:629-077-4
DSSTox Substance ID:DTXSID601267281
Nikkaji Number:J790.247F
Mol file:1548-84-1.mol

Synonyms:Perfluorophenyl benzoate;1548-84-1;Pentafluorophenyl benzoate;Benzoic acid pentafluorophenyl ester;(2,3,4,5,6-pentafluorophenyl) Benzoate;Perfluorophenylbenzoate;Benzoic acid pentafluorophenyl ester, BzOPfp;SCHEMBL7086238;WZPWTXZSQHIABL-UHFFFAOYSA-N;DTXSID601267281;BAA54884;Benzoic acid, pentafluorophenyl ester;MFCD00483755;AS-67753;P2229;2,3,4,5,6-PENTAFLUOROPHENYL BENZOATE;Pentafluorophenyl benzoate, >=98.0% (HPLC);T71843;Phenol, 2,3,4,5,6-pentafluoro-, 1-benzoate

Suppliers and Price of Perfluorophenyl 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

TRC
Pentafluorophenyl Benzoate
100mg
$ 60.00

TCI Chemical
Pentafluorophenyl Benzoate >98.0%(GC)
1g
$ 57.00

TCI Chemical
Pentafluorophenyl Benzoate >98.0%(GC)
5g
$ 193.00

Crysdot
Perfluorophenylbenzoate 95+%
5g
$ 225.00

Chem-Impex
Pentafluorophenylbenzoate,98%(GC) 98%(GC)
5G
$ 201.60

Chem-Impex
Pentafluorophenylbenzoate,98%(GC) 98%(GC)
1G
$ 56.00

Chem-Impex
Pentafluorophenylbenzoate,≥98%(GC) ≥98%(GC)
250MG
$ 29.12

Apolloscientific
Benzoicacidpentafluorophenylester 98%
1g
$ 24.00

Apolloscientific
Benzoicacidpentafluorophenylester 98%
5g
$ 82.00

Alichem
Perfluorophenylbenzoate
25g
$ 547.05

Total 9 raw suppliers

Chemical Property of Perfluorophenyl benzoate

Chemical Property:

Melting Point:73-74 °C(lit.)
Boiling Point:371.7±42.0 °C(Predicted)
PSA：26.30000
Density:1.486±0.06 g/cm3(Predicted)
LogP:3.60130
Storage Temp.:2-8°C
Solubility.:soluble in Toluene
XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:288.02097021
Heavy Atom Count:20
Complexity:332

Purity/Quality:

97% ^*data from raw suppliers

Pentafluorophenyl Benzoate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:N
Statements: 50/53
Safety Statements: 60-61

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(=O)OC2=C(C(=C(C(=C2F)F)F)F)F

Technology Process of Perfluorophenyl benzoate

There total 10 articles about Perfluorophenyl 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: 98.0%

: 771-61-9
2,3,4,5,6-pentafluorophenol

: 65-85-0,8013-63-6
benzoic acid

: 1548-84-1
pentafluorophenyl benzoate

Guidance literature:: With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; at 0 - 20 ℃; for 16h; Inert atmosphere;
DOI:10.1021/acs.joc.0c01182

Reference yield: 89.0%

: 771-61-9
2,3,4,5,6-pentafluorophenol

: 98-88-4
benzoyl chloride

: 1548-84-1
pentafluorophenyl benzoate

Guidance literature:: With dmap; triethylamine; In dichloromethane; at 0 - 20 ℃; Inert atmosphere;
DOI:10.1021/acs.orglett.1c00940

Reference yield: 72.0%

: 100-52-7
benzaldehyde

: 188837-53-8
(2,3,4,5,6-pentafluorophenyl)pyridine-2-carboxylate

: 1548-84-1
pentafluorophenyl benzoate

Guidance literature:: (2,3,4,5,6-pentafluorophenyl)pyridine-2-carboxylate; With palladium diacetate; 1,2-bis-(diphenylphosphino)ethane; In toluene; at 115 ℃; for 0.166667h;

benzaldehyde; With tert.-butylhydroperoxide; In toluene; for 48h; Reflux;
DOI:10.1021/jo3012573