5-Allyl-2-(pentyloxy)anisole

Base Information

• Chemical Name: 5-Allyl-2-(pentyloxy)anisole
• CAS No.: 94291-83-5
• Molecular Formula: C15H22 O2
• Molecular Weight: 234.338
• Hs Code.: 2909309090
• European Community (EC) Number: 304-910-1
• UNII: LC83KCP7CC
• DSSTox Substance ID: DTXSID90241400
• Nikkaji Number: J179.201F
• Wikidata: Q83124909
• ChEMBL ID: CHEMBL4164495
• Mol file: 94291-83-5.mol

Synonyms:5-Allyl-2-(pentyloxy)anisole;LC83KCP7CC;94291-83-5;EINECS 304-910-1;UNII-LC83KCP7CC;2-Methoxy-4-(2-propenyl)phenylpentyl ether;SCHEMBL357725;CHEMBL4164495;DTXSID90241400;2-METHOXY-1-(PENTYLOXY)-4-(2-PROPEN-1-YL)BENZENE;BENZENE, 2-METHOXY-1-(PENTYLOXY)-4-(2-PROPEN-1-YL)-

Chemical Property of 5-Allyl-2-(pentyloxy)anisole

Chemical Property:

• Vapor Pressure: 0.000832mmHg at 25°C
• Boiling Point: 315°Cat760mmHg
• Flash Point: 109.6°C
• PSA: 18.46000
• Density: 0.945g/cm³
• LogP: 3.99270
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 8
• Exact Mass: 234.161979940
• Heavy Atom Count: 17
• Complexity: 203

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCOC1=C(C=C(C=C1)CC=C)OC

Technology Process of 5-Allyl-2-(pentyloxy)anisole

There total 3 articles about 5-Allyl-2-(pentyloxy)anisole 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: 63.0%

C15H21BrO2 (1612865-71-0) → (2-methoxy-4-prop-2-enylphenoxy)pentane (94291-83-5)

Guidance literature:

With [1,3-bis(2,6-di-iso-propylphenyl)imidazol-2-ylidene]copper(I) tert-butoxide; diphenylsilane; 2-tert-butylphenol potassium salt; In 1,4-dioxane; at 25 ℃; for 24h; chemoselective reaction; Inert atmosphere; Glovebox;

DOI:10.1016/j.tet.2014.04.004

Reference yield: 60.6%

4-allylguaiacol (97-53-0) + 1-Bromopentane (110-53-2) → (2-methoxy-4-prop-2-enylphenoxy)pentane (94291-83-5)

Guidance literature:

4-allylguaiacol; With sodium hydride; In N,N-dimethyl-formamide; at 0 ℃; for 0.166667h;

1-Bromopentane; In N,N-dimethyl-formamide; at 20 ℃; for 2h;

DOI:10.1016/j.ejmech.2017.08.030

Reference yield:

→ (2-methoxy-4-prop-2-enylphenoxy)pentane (94291-83-5)

Guidance literature:

/BRN= 3267082/;

upstream raw materials:

C₁₅H₂₁BrO₂

4-allylguaiacol

1-Bromopentane

Refernces

• 1、 Cox, Nick,Dang, Hester,Whittaker, Aaron M.,Lalic, Gojko. "NHC-copper hydrides as chemoselective reducing agents: Catalytic reduction of alkynes, alkyl triflates, and alkyl halides". supporting information. p. 4219 - 4231. Retrieved 2014/06/09.