Allyl ether

Base Information

• Chemical Name: Allyl ether
• CAS No.: 557-40-4
• Molecular Formula: C6H10 O
• Molecular Weight: 98.1448
• European Community (EC) Number: 209-174-4
• ICSC Number: 1071
• NSC Number: 7619
• UN Number: 2360
• UNII: GI3WXY29NQ
• DSSTox Substance ID: DTXSID8060321
• Nikkaji Number: J6.485H
• Wikidata: Q2001786
• Mol file: 557-40-4.mol

Synonyms:ALLYL ETHER;Diallyl ether;557-40-4;Allylether;Ether, diallyl;1-Propene, 3,3'-oxybis-;Diallylether;3-prop-2-enoxyprop-1-ene;3,3'-Oxybis(1-propene);Ether, propenyl;3-(prop-2-en-1-yloxy)prop-1-ene;NSC 7619;EINECS 209-174-4;UNII-GI3WXY29NQ;3-(allyloxy)prop-1-ene;UN2360;GI3WXY29NQ;BRN 1736015;3-(2-Propenoxy)-1-propene;AI3-02894;NSC-7619;4-01-00-02086 (Beilstein Handbook Reference);71586-81-7;3-allyloxyprop-1-ene;monoallyl ether;Bis(allyl) ether;Allyl ether, 98%;1-Propene,3'-oxybis-;33'-Oxybis-1-propene;4-Oxahepta-1 6-diene;3-(aliloxi)-1-propeno;Allyl ether (6CI8CI);3,3'-oxibis-1-propeno;3-(Allyloxy)-1-propene;ALLYL ETHER [MI];3-prop-2-enoxy-1-propene;Allyl ether (Diallyl ether);1-propeno, 3,3'-oxibis-;3,3'-oxybis(prop-1-ene);3-(Allyloxy)-1-propene #;(CH2=CHCH2)2O;3-(2-propenoxi)-1-propeno;WLN: 1U2O2U1;DTXSID8060321;NSC7619;3,3'-OXYBIS-1-PROPENE;MFCD00008650;NA2360;STL453702;AKOS015903336;UN 2360;LS-67813;Diallylether [UN2360] [Flammable liquid];A0229;Diallylether [UN2360] [Flammable liquid];FT-0621999;EN300-94926;D88230;A830779;Q2001786

Chemical Property of Allyl ether

Chemical Property:

• Appearance/Colour: clear colorless liquid
• Vapor Pressure: 50.7mmHg at 25°C
• Boiling Point: 94-95 ºC
• Flash Point: -7 ºC
• PSA: 9.23000
• Density: 0.803
• LogP: 1.37500
• Water Solubility.: insoluble
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 98.073164938
• Heavy Atom Count: 7
• Complexity: 49.2
• Transport DOT Label: Flammable Liquid Poison

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Hazard Codes: F:Flammable;;
• Statements: R11:; R20/21/22:; R36/37/38:
• Safety Statements: S16:; S26:; S33:; S36/37/39:; S9:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C=CCOCC=C
• Inhalation Risk: No indication can be given about the rate at which a harmful concentration of this substance in the air is reached on evaporation at 20 °C.
• Effects of Short Term Exposure: The vapour is irritating to the eyes, skin and respiratory tract. The substance may cause effects on the central nervous system. This may result in lowering of consciousness.
• Effects of Long Term Exposure: The substance defats the skin, which may cause dryness or cracking.

Technology Process of Allyl ether

There total 73 articles about Allyl 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: 99.0%

allyl propargyl ether (51580-41-7) → Allyl ether (557-40-4)

Guidance literature:

With hydrogen; In toluene; at 20 ℃; for 30h; under 22801.5 Torr; Autoclave;

DOI:10.1021/jacs.5b07521

Reference yield: 95.0%

allyl alcohol (107-18-6) → Allyl ether (557-40-4)

Guidance literature:

With sodium sulfate; tetrakis(triphenyl phosphite)palladium⁽⁰⁾; at 80 ℃;

DOI:10.1021/jo030370g

Reference yield: 93.0%

carbon dioxide (124-38-9,18923-20-1) + allyl alcohol (107-18-6) → Allyl ether (557-40-4) + diallylcarbonate (15022-08-9)

Guidance literature:

With copper (I) iodide; dicyclohexyl-carbodiimide; at 64.85 ℃; for 4h; under 37503 Torr;

DOI:10.1021/jo050392y

upstream raw materials:

allyl iodid

ethanol

allyl alcohol

allyl bromide

Downstream raw materials:

1-Heptene

allyl alcohol

acrolein

allyl octyl ether

Refernces

• 1、 -. "Preparation method of epoxy silane coupling agent". Paragraph 0033-0035; 0039-0041; 0045-0047; 0051-0053; .... . Retrieved 2021/05/05.
• 2、 Barbosa, Eduardo C. M.,Camargo, Pedro H. C.,Fiorio, Jhonatan L.,Hashmi, A. Stephen K.,Kikuchi, Danielle K.,Rossi, Liane M.,Rudolph, Matthias. "Piperazine-promoted gold-catalyzed hydrogenation: The influence of capping ligands". . p. 1996 - 2003. Retrieved 2020/04/22.