Methyl 3-(heptadecafluorooctyl)benzoate

Base Information

Chemical Name:Methyl 3-(heptadecafluorooctyl)benzoate
CAS No.:80791-11-3
Molecular Formula:C16H7F17O2
Molecular Weight:554.203
Hs Code.:
DSSTox Substance ID:DTXSID00512037
Wikidata:Q82371115

Synonyms:Methyl 3-(heptadecafluorooctyl)benzoate;80791-11-3;DTXSID00512037;NS00108812

Suppliers and Price of Methyl 3-(heptadecafluorooctyl)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 1 raw suppliers

Chemical Property of Methyl 3-(heptadecafluorooctyl)benzoate

Chemical Property:

XLogP3:7.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:19
Rotatable Bond Count:9
Exact Mass:554.0174582
Heavy Atom Count:35
Complexity:785

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of Methyl 3-(heptadecafluorooctyl)benzoate

There total 1 articles about Methyl 3-(heptadecafluorooctyl)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: 90.0%

: 507-63-1
1-iodoheptadecafluorooctane

: 618-91-7
methyl 3-iodo-benzoate

: 80791-11-3
methyl 3-perfluorooctylbenzoate

Guidance literature:: With iodine; copper; In N,N-dimethyl-formamide; at 130 ℃; for 15h;
DOI:10.1016/S0040-4020(97)00272-X

Reference yield: 95.0%

: 80791-11-3
methyl 3-perfluorooctylbenzoate

: 190722-75-9
(3-Heptadecafluorooctyl-phenyl)-methanol

Guidance literature:: With lithium aluminium tetrahydride; In diethyl ether; for 2h; Ambient temperature;
DOI:10.1016/S0040-4020(97)00272-X

Reference yield:

: 80791-11-3
methyl 3-perfluorooctylbenzoate

: 134641-34-2
3-Heptadecafluorooctyl-benzaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: 95 percent / LiAlH₄ / diethyl ether / 2 h / Ambient temperature

2: 82 percent / MnO₂ / CHCl₃ / 8 h / Heating

With manganese(IV) oxide; lithium aluminium tetrahydride; In diethyl ether; chloroform;
DOI:10.1016/S0040-4020(97)00272-X