2-Benzyl-4-phenyl-1,3-dioxolane

Base Information

• Chemical Name: 2-Benzyl-4-phenyl-1,3-dioxolane
• CAS No.: 4362-20-3
• Molecular Formula: C16H16 O2
• Molecular Weight: 240.302
• Hs Code.: 2932999099
• European Community (EC) Number: 224-448-3
• NSC Number: 45662
• DSSTox Substance ID: DTXSID00884064
• Nikkaji Number: J205.745J
• Mol file: 4362-20-3.mol

Synonyms:2-Benzyl-4-phenyl-1,3-dioxolane;4362-20-3;1,3-Dioxolane, 4-phenyl-2-(phenylmethyl)-;Phenylacetaldehyde phenylethylene glycol acetal;EINECS 224-448-3;NSC 45662;1,3-Dioxolane, 2-benzyl-4-phenyl-;NSC45662;1, 2-benzyl-4-phenyl-;DTXSID00884064;NSC-45662

Chemical Property of 2-Benzyl-4-phenyl-1,3-dioxolane

Chemical Property:

• Vapor Pressure: 3.44E-05mmHg at 25°C
• Boiling Point: 364.8°Cat760mmHg
• Flash Point: 191.4°C
• PSA: 18.46000
• Density: 1.126g/cm³
• LogP: 3.34330
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 240.115029749
• Heavy Atom Count: 18
• Complexity: 242

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(OC(O1)CC2=CC=CC=C2)C3=CC=CC=C3

Technology Process of 2-Benzyl-4-phenyl-1,3-dioxolane

There total 8 articles about 2-Benzyl-4-phenyl-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: 36.0%

styrene (100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6) + phenylethane 1,2-diol (93-56-1) → 2-benzyl-4-phenyl-[1,3]dioxolane (4362-20-3)

Guidance literature:

With iron(III) sulfate hydrate; palladium dichloride; In water; acetonitrile; at 45 ℃; for 48h; regioselective reaction;

DOI:10.1039/d1ob02227j

Reference yield:

styrene oxide (96-09-3) → 2-benzyl-4-phenyl-[1,3]dioxolane (4362-20-3)

Guidance literature:

With acetophenone; zinc(II) chloride;

DOI:10.1021/ja01624a043

Reference yield:

styrene oxide (96-09-3) → 2-benzyl-4-phenyl-[1,3]dioxolane (4362-20-3) + 2-methyl-2,4-diphenyl-[1,3]dioxolane (101854-08-4)

Guidance literature:

With hydrogenchloride;

DOI:10.1021/ja01624a043

upstream raw materials:

styrene oxide

hydrogen bromide

tin(IV) chloride

benzene

Refernces

• 1、 Shuler, William G.,Combee, Logan A.,Falk, Isaac D.,Hilinski, Michael K.. "Intermolecular Electrophilic Addition of Epoxides to Alkenes: [3+2] Cycloadditions Catalyzed by Lewis Acids". supporting information. p. 3335 - 3338. Retrieved 2016/07/23.