Allyl butyl ether

Base Information

• Chemical Name: Allyl butyl ether
• CAS No.: 3739-64-8
• Molecular Formula: C7H14 O
• Molecular Weight: 114.188
• Hs Code.: 2909199090
• European Community (EC) Number: 223-122-8
• DSSTox Substance ID: DTXSID10190825
• Nikkaji Number: J38.385F
• Wikidata: Q83063272
• Mol file: 3739-64-8.mol

Synonyms:Allyl butyl ether;3739-64-8;1-prop-2-enoxybutane;1-(Allyloxy)butane;Ether, allyl butyl;Butyl allyl ether;Allyl n-butyl ether;ALLYLBUTYLETHER;Butane, 1-(2-propenyloxy)-;Allyl n- butyl ether;EINECS 223-122-8;AI3-18265;3-Butoxy-1-propene #;Allyl butyl ether, 98%;SCHEMBL42944;1-(prop-2-en-1-yloxy)butane;DTXSID10190825;MFCD00009460;AKOS015912465;BS-23469;FT-0634995;D88441;(1S,4S)-(+)-2-(2,4-difluoro-benzyl)-2,5-diaza-bicyclo[2.2.1]heptane

Chemical Property of Allyl butyl ether

Chemical Property:

• Vapor Pressure: 19.1mmHg at 25°C
• Refractive Index: n20/D 1.406(lit.)
• Boiling Point: 119.4°Cat760mmHg
• Flash Point: 14.4°C
• PSA: 9.23000
• Density: 0.784g/cm³
• LogP: 1.98910
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 114.104465066
• Heavy Atom Count: 8
• Complexity: 50.3

Purity/Quality:

98%,99%, ^*data from raw suppliers

Allyl Butyl Ether ^*data from reagent suppliers

Safty Information:

• Hazard Codes: F,Xi
• Statements: 11-36/37/38
• Safety Statements: 16-26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCOCC=C

Technology Process of Allyl butyl ether

There total 15 articles about Allyl butyl 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: 100.0%

allyl alcohol (107-18-6) + butan-1-ol (71-36-3) → allyl n-butyl ether (3739-64-8)

Guidance literature:

butan-1-ol; With RuCpCl(o-EtOdppe); silver(I) 4-methylbenzenesulfonate; In toluene; for 0.0833333h; Inert atmosphere;

allyl alcohol; In toluene; at 100 ℃; for 2h; regioselective reaction; Inert atmosphere;

DOI:10.1002/aoc.1744

Reference yield: 98.0%

allyl bromide (106-95-6) + butan-1-ol (71-36-3) → allyl n-butyl ether (3739-64-8)

Guidance literature:

With copper; In N,N-dimethyl-formamide; Heating;

Reference yield: 95.0%

3-chloroprop-1-ene (107-05-1) + butan-1-ol (71-36-3) → allyl n-butyl ether (3739-64-8)

Guidance literature:

With sodium hydroxide; cetyltrimethylammonim bromide; In water; at 70 ℃;

DOI:10.1016/S0040-4020(01)90106-1

upstream raw materials:

allyl alcohol

butan-1-ol

allyl bromide

sodium butanolate

Downstream raw materials:

1-Decene

allylbenzene

butan-1-ol

3,3-dimethoxyprop-1-ene

Refernces

• 1、 Iranpoor, Nasser,Firouzabadi, Habib,Etemadidavan, Elham. "1,3,2,4-diazadiphosphetidine-based phosphazane oligomers as source of P(III) atom economy reagents: Conversion of epoxides to vic -haloalcohols, vic -dihalides, and alkenes in the presence of halogen sources". . p. 1165 - 1173. Retrieved 2014/10/16.
• 2、 Van Rijn, Jimmy A.,Guijt, Marieke C.,De Vries, Dwight,Bouwman, Elisabeth,Drent, Eite. "Scope of the allylation reaction with [RuCp(PP)]+ catalysts: Changing the nucleophile or allylic alcohol". experimental part. p. 212 - 219. Retrieved 2012/04/17.