2-[(4-Methoxyphenyl)methyl]-1,3-dioxolane

Base Information

• Chemical Name: 2-[(4-Methoxyphenyl)methyl]-1,3-dioxolane
• CAS No.: 91970-78-4
• Molecular Formula: C11H14O3
• Molecular Weight: 194.23
• Hs Code.: 2932999099
• DSSTox Substance ID: DTXSID70374447
• Nikkaji Number: J934.985E
• Wikidata: Q82163045
• Mol file: 91970-78-4.mol

Synonyms:91970-78-4;2-[(4-methoxyphenyl)methyl]-1,3-dioxolane;2-(4-methoxybenzyl)-1,3-dioxolane;4-(1,3-DIOXOLAN-2-YLMETHYL)-1-METHOXYBENZENE;4-(1,3-Dioxolan-2-ylmethyl)anisole;SCHEMBL3296090;DTXSID70374447;MFCD04117676;AKOS006345779

Chemical Property of 2-[(4-Methoxyphenyl)methyl]-1,3-dioxolane

Chemical Property:

• Vapor Pressure: 0.00336mmHg at 25°C
• Boiling Point: 291.7oC at 760 mmHg
• Flash Point: 96.9oC
• PSA: 27.69000
• Density: 1.122g/cm3
• LogP: 1.61060
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 194.094294304
• Heavy Atom Count: 14
• Complexity: 158

Purity/Quality:

97% ^*data from raw suppliers

4-(1,3-DIOXOLAN-2-YLMETHYL)-1-METHOXYBENZENE ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)CC2OCCO2

Technology Process of 2-[(4-Methoxyphenyl)methyl]-1,3-dioxolane

There total 6 articles about 2-[(4-Methoxyphenyl)methyl]-1,3-dioxolane 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: 93.0%

2-(2-iodo-1-(4-methoxyphenyl)ethoxy)ethanol → 2-(4-methoxybenzyl)-1,3-dioxolane (91970-78-4)

Guidance literature:

With Oxone; In ethylene glycol; at 20 ℃; for 2h;

DOI:10.1039/c5ra11092k

Reference yield: 56.0%

2-bromomethyl-1,3-dioxolane (4360-63-8) + para-iodoanisole (696-62-8) → 2-(4-methoxybenzyl)-1,3-dioxolane (91970-78-4)

Guidance literature:

With pyridine; ethyl crotonate; nickel dichloride; zinc; In acetonitrile; at 20 ℃; for 8h; Inert atmosphere;

DOI:10.1002/chem.201200190

Reference yield:

2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethan-1-ol + ethylene glycol (107-21-1) → 2-(4-methoxybenzyl)-1,3-dioxolane (91970-78-4) + 2-methoxy-phenol (90-05-1)

Guidance literature:

With iron(III) trifluoromethanesulfonate; In 1,4-dioxane; at 140 ℃; for 2h; Reagent/catalyst; Sealed tube;

DOI:10.1002/cssc.201600831

upstream raw materials:

2-bromomethyl-1,3-dioxolane

para-iodoanisole

ethylene glycol

4-Methoxystyrene

Downstream raw materials:

ethylene glycol monoformate

4-methoxybenzyl nitrate

4-methoxy-benzaldehyde