Phenol, 2-[(2-methyl-2-propenyl)oxy]-

Base Information

• Chemical Name: Phenol, 2-[(2-methyl-2-propenyl)oxy]-
• CAS No.: 4790-71-0
• Molecular Formula: C10H12 O2
• Molecular Weight: 164.204
• UNII: 1YA408W9MC
• DSSTox Substance ID: DTXSID9027578
• Nikkaji Number: J70.925E
• Wikidata: Q27253181
• Mol file: 4790-71-0.mol

Synonyms:o-Methallyloxyphenol;4790-71-0;Phenol, 2-[(2-methyl-2-propenyl)oxy]-;2-Methallyloxyphenol;Phenol, 2-((2-methyl-2-propenyl)oxy)-;2-(2-Methylallyloxy)phenol;UNII-1YA408W9MC;1YA408W9MC;Phenol, 2-((2-methyl-2-propen-1-yl)oxy)-;2-[(2-methyl-2-propenyl)oxy]phenol;methallyloxyphenol;2-((2-methyl-2-propenyl)oxy)-phenol;2-[(2-methylprop-2-en-1-yl)oxy]phenol;2-((2-METHYL-2-PROPENYL)OXY)PHENOL;2-[(2-METHYL-2-PROPENYL)OXY]-PHENOL;ortho-methallyloxyphenol;SCHEMBL8390273;DTXSID9027578;AKOS009316814;PYROCATECHOL MONOMETHALLYL ETHER;2-HYDROXYPHENYL METHALLYL ETHER;J70.925E;LS-195361;PHENOL, 2-(2-METHYL-2-PROPEN-1-YL)OXY)-;Q27253181

Chemical Property of Phenol, 2-[(2-methyl-2-propenyl)oxy]-

Chemical Property:

• Vapor Pressure: 0.00656mmHg at 25°C
• Boiling Point: 262.8°Cat760mmHg
• PKA: 9.60±0.30(Predicted)
• Flash Point: 118°C
• PSA: 29.46000
• Density: 1.05g/cm³
• LogP: 2.34710
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 164.083729621
• Heavy Atom Count: 12
• Complexity: 154

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=C)COC1=CC=CC=C1O

Technology Process of Phenol, 2-[(2-methyl-2-propenyl)oxy]-

There total 9 articles about Phenol, 2-[(2-methyl-2-propenyl)oxy]- 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: 90.5%

→ ortho-methallylpyrocatechol (4790-71-0)

Guidance literature:

Reference yield: 90.32%

benzene-1,2-diol (120-80-9,19481-10-8,37349-32-9) + 3-Chloro-2-methylpropene (563-47-3) → ortho-methallylpyrocatechol (4790-71-0)

Guidance literature:

With sodium carbonate; potassium iodide; at 100 ℃; for 12h; Temperature; Concentration;

Reference yield: 73.0%

3-methylene-3,4-dihydro-2H-benzo[b][1,4]dioxepine (19560-64-6) → ortho-methallylpyrocatechol (4790-71-0)

Guidance literature:

With methanol; potassium hydroxide; palladium on activated charcoal; at 20 ℃; for 7h;

DOI:10.1248/cpb.54.1299

upstream raw materials:

2-methylprop-1-enyl chloride

pyrocatechol monosodium salt

benzene-1,2-diol

3-Chloro-2-methylpropene

Downstream raw materials:

2-p-Bromphenylthiomethyl-2-methyl-2,3-dihydrobenzo-1,4-dioxin

2-Methyl-2-phenylthiomethyl-2,3-dihydrobenzo-1,4-dioxin

2-p-Chlorphenylthiomethyl-2-methyl-2,3-dihydrobenzo-1,4-dioxin

C₂₀H₁₇NO₃