Allyl 2-pyridyl ether

Base Information

• Chemical Name: Allyl 2-pyridyl ether
• CAS No.: 5831-77-6
• Molecular Formula: C8H9 N O
• Molecular Weight: 135.166
• Hs Code.: 2933399090
• European Community (EC) Number: 227-409-9
• NSC Number: 76542
• DSSTox Substance ID: DTXSID10207043
• Nikkaji Number: J218.086C
• Wikidata: Q83080935
• Mol file: 5831-77-6.mol

Synonyms:2-ALLYLOXYPYRIDINE;5831-77-6;Allyl 2-pyridyl ether;2-prop-2-enoxypyridine;2-(prop-2-en-1-yloxy)pyridine;EINECS 227-409-9;2-(ALLYLOXY)PYRIDINE;NSC76542;2-(2-Propenyloxy)pyridine;SCHEMBL3260151;DTXSID10207043;MFCD00023467;NSC 76542;NSC-76542;AKOS006220904;FT-0635871;F6608-1416

Chemical Property of Allyl 2-pyridyl ether

Chemical Property:

• Vapor Pressure: 0.63mmHg at 25°C
• Boiling Point: 194°Cat760mmHg
• PKA: 4.41±0.19(Predicted)
• Flash Point: 69.4°C
• PSA: 22.12000
• Density: 1.002g/cm³
• LogP: 1.64640
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 135.068413911
• Heavy Atom Count: 10
• Complexity: 103

Purity/Quality:

99% ^*data from raw suppliers

2-Allyl-oxypyridine ^*data from reagent suppliers

Safty Information:

• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C=CCOC1=CC=CC=N1

Technology Process of Allyl 2-pyridyl ether

There total 7 articles about Allyl 2-pyridyl 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: 95.0%

2-chloropyridine (109-09-1) + allyl alcohol (107-18-6) → 2-allyloxypyridine (5831-77-6)

Guidance literature:

With 18-crown-6 ether; potassium hydroxide; In toluene; for 2h; Inert atmosphere; Reflux;

DOI:10.1016/j.tetlet.2015.10.085

Reference yield: 95.0%

2-allyloxypyridine N-oxide (20173-55-1) → 2-allyloxypyridine (5831-77-6)

Guidance literature:

With indium; ammonium chloride; In methanol; water; for 5h; Heating;

DOI:10.1016/S0040-4039(00)00218-5

Reference yield:

2-hydroxypyridin (142-08-5) + 3-chloroprop-1-ene (107-05-1) → 1-(prop-2-enyl)-1,2-dihydropyridine-2-one (21997-30-8) + 2-allyloxypyridine (5831-77-6)

Guidance literature:

2-hydroxypyridin; With sodium methylate; at 25 ℃; for 0.5h; Ionic liquid; Inert atmosphere;

3-chloroprop-1-ene; at 25 ℃; for 5h; Reagent/catalyst; Solvent; Ionic liquid; Inert atmosphere;

DOI:10.1007/s10593-008-0074-9

upstream raw materials:

2-chloropyridine

sodium allyloxide

allyl alcohol

2-bromo-pyridine

Downstream raw materials:

methyl 3-chlorobenzoate

allyl 3-chlorobenzoate

allyl 2-chlorobenzoate

(E)-allyl cinnamate

Refernces

• 1、 Vavilina,Zicmanis,Mekss,Klavins. "Alkylation of the 2-hydroxypyridine anion in ionic liquid media". . p. 549 - 558. Retrieved 2013/07/27.
• 2、 Westwell, Andrew D.,Williams, Jonathan M. J.. "Auxiliary accelerated reactions: Towards the use of catalytic chiral auxiliaries". . p. 13063 - 13078. Retrieved 2007/10/03.