Phenol, 2,6-diallyl-4-methoxy-

Base Information

• Chemical Name: Phenol, 2,6-diallyl-4-methoxy-
• CAS No.: 64047-87-6
• Molecular Formula: C13H16 O2
• Molecular Weight: 204.269
• Hs Code.: 2909500000
• NSC Number: 78750
• DSSTox Substance ID: DTXSID40214129
• Nikkaji Number: J79.298E
• Wikidata: Q83089890
• Mol file: 64047-87-6.mol

Synonyms:Phenol, 2,6-diallyl-4-methoxy-;64047-87-6;2,6-Diallyl-4-methoxyphenol;BRN 3268410;NSC78750;Phenol,6-di-2-propenyl-;TimTec1_008198;NCIOpen2_004337;Oprea1_103376;Oprea1_845888;4-06-00-06466 (Beilstein Handbook Reference);SCHEMBL10427944;DTXSID40214129;HMS1557E14;NSC 78750;NSC-78750

Chemical Property of Phenol, 2,6-diallyl-4-methoxy-

Chemical Property:

• Vapor Pressure: 0.000228mmHg at 25°C
• Boiling Point: 316°Cat760mmHg
• Flash Point: 142.7°C
• PSA: 29.46000
• Density: 1.017g/cm³
• LogP: 2.85780
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 204.115029749
• Heavy Atom Count: 15
• Complexity: 193

Purity/Quality:

99% ^*data from raw suppliers

2,6-DIALLYL-4-METHOXYPHENOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C(=C1)CC=C)O)CC=C

Technology Process of Phenol, 2,6-diallyl-4-methoxy-

There total 6 articles about Phenol, 2,6-diallyl-4-methoxy- 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: 70.0%

2-allyl-1-allyloxy-4-methoxy-benzene (205433-77-8) → 4-methoxy-2,6-di(2-propenyl)phenol (64047-87-6)

Guidance literature:

at 190 ℃; for 12h;

DOI:10.1002/jccs.199800001

Reference yield:

2-allyl-4-methoxyphenol (584-82-7) → 4-methoxy-2,6-di(2-propenyl)phenol (64047-87-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 99 percent / K₂CO₃ / butan-2-one / 18 h / Heating

2: 70 percent / 12 h / 190 °C

With potassium carbonate; In butanone;

DOI:10.1002/jccs.199800001

Reference yield:

allyl (4-methoxyphenyl) ether (13391-35-0) → 4-methoxy-2,6-di(2-propenyl)phenol (64047-87-6)

Guidance literature:

Multi-step reaction with 3 steps

1: 85 percent / 12 h / 185 °C

2: 99 percent / K₂CO₃ / butan-2-one / 18 h / Heating

3: 70 percent / 12 h / 190 °C

With potassium carbonate; In butanone;

DOI:10.1002/jccs.199800001

upstream raw materials:

2-allyl-1-allyloxy-4-methoxy-benzene

allyl (4-methoxyphenyl) ether

2-allyl-4-methoxyphenol

4-methoxy-phenol

Downstream raw materials:

2,6-di(3-methyl-2-butenyl)benzene-1,4-diol

3-[4-acetoxy-3,5-bis(3-methyl-2-butenyl)phenyl]-(2E)-propenoic acid methyl ester

artepillin C

C₂₀H₂₆O₆

Refernces

• 1、 Yashiro, Kazuki,Hanaya, Kengo,Shoji, Mitsuru,Sugai, Takeshi. "New synthesis of artepillin C, a prenylated phenol, utilizing lipase-catalyzed regioselective deacetylation as the key step". . p. 1926 - 1930. Retrieved 2015/11/24.