Allyl 1H,1H-perfluorooctyl ether

Base Information

• Chemical Name: Allyl 1H,1H-perfluorooctyl ether
• CAS No.: 812-72-6
• Molecular Formula: C11H7 F15 O
• Molecular Weight: 440.15
• DSSTox Substance ID: DTXSID00370992
• Nikkaji Number: J1.978.656K
• Wikidata: Q82158194
• Mol file: 812-72-6.mol

Synonyms:Allyl 1H,1H-perfluorooctyl ether;812-72-6;1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluoro-8-prop-2-enoxyoctane;8-(allyloxy)-1,1,1,2,2,3,3,4,4,5,5,6,6,7,7-pentadecafluorooctane;PC0016;C7F15CH2OCH2CH=CH2;SCHEMBL5704622;DTXSID00370992;MFCD00042149;AKOS007930735;Allyl-1H,1H-Pentadecafluorooctyl ether;Allyl 1H,1H-pentadecafluorooct-1-yl ether;CS-0455980;FT-0676157;Allyl(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctyl) ether;S(-)-ALPHA-AMINO-3,4-DIHYDRO-2,4-DIOXO-1(2H)-PYRIMIDINEPROPANOICACID

Chemical Property of Allyl 1H,1H-perfluorooctyl ether

Chemical Property:

• Vapor Pressure: 0.79mmHg at 25°C
• Refractive Index: 1.3222
• Boiling Point: 178°C
• Flash Point: 74.7°C
• PSA: 9.23000
• Density: 1,561 g/cm3
• LogP: 5.56310
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 9
• Exact Mass: 440.0257373
• Heavy Atom Count: 27
• Complexity: 532

Purity/Quality:

98%Min ^*data from raw suppliers

Allyl1H,1H-PerfluorooctylEther ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCOCC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Technology Process of Allyl 1H,1H-perfluorooctyl ether

There total 5 articles about Allyl 1H,1H-perfluorooctyl ether 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: 96.0%

2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-1-octanol (307-30-2) + 3-chloroprop-1-ene (107-05-1) → 1H,1H-pentadecafluorooctyl allyl ether (812-72-6)

Guidance literature:

With sodium hydroxide; tetramethylammonium hydrogen sulfate; at 40 ℃; for 12h;

DOI:10.1021/ja952225t

Reference yield: 76.0%

2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-1-octanol (307-30-2) + allyl bromide (106-95-6) → 1H,1H-pentadecafluorooctyl allyl ether (812-72-6)

Guidance literature:

With potassium hydroxide; In dimethyl sulfoxide; at 20 ℃; for 4h;

DOI:10.1021/jp013820m

Reference yield:

Perfluorooctanoic acid (335-67-1) → 1H,1H-pentadecafluorooctyl allyl ether (812-72-6)

Guidance literature:

Multi-step reaction with 3 steps

1: H₂SO₄

2: LiAlH₄

3: K₂CO₃ / acetone

With lithium aluminium tetrahydride; sulfuric acid; potassium carbonate; In acetone;

DOI:10.1021/jo01066a076

upstream raw materials:

2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluoro-1-octanol

allyl bromide

3-chloroprop-1-ene

Perfluorooctanoic acid

Refernces

• 1、 Wang, Xiaobai,Ye, Qun,Song, Jing,Cho, Ching Mui,He, Chaobin,Xu, Jianwei. "Fluorinated polyhedral oligomeric silsesquioxanes". . p. 4547 - 4553. Retrieved 2015/02/19.