(1-Phenylethyl)xylene

Base Information

• Chemical Name: (1-Phenylethyl)xylene
• CAS No.: 81749-28-2
• Deprecated CAS: 75497-52-8,66746-31-4,82116-30-1
• Molecular Formula: C16H18
• Molecular Weight: 210.319
• European Community (EC) Number: 255-068-6
• UNII: 38NC63HG2I
• DSSTox Substance ID: DTXSID10866013
• Nikkaji Number: J116.694H
• Wikidata: Q27256800
• Mol file: 81749-28-2.mol

Synonyms:(1-phenylethyl)xylene;phenylxylylethane

Chemical Property of (1-Phenylethyl)xylene

Chemical Property:

• PSA: 0.00000
• LogP: 4.45520
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 210.140850574
• Heavy Atom Count: 16
• Complexity: 202

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Classes -> Aromatic Hydrocarbons
• Canonical SMILES: CC1=C(C(=CC=C1)C(C)C2=CC=CC=C2)C

Technology Process of (1-Phenylethyl)xylene

There total 6 articles about (1-Phenylethyl)xylene 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: 93.9%

styrene (100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6) + o-xylene (95-47-6) → 1,2-dimethyl-2-(1-phenylethyl)benzene (81749-28-2) + 1,2-dimethyl-4-(1-phenylethyl)benzene (6196-95-8)

Guidance literature:

With immobilized 30percent 12-tungstophosphoric acid-imidazole(1H)-3-ium-3-triethoxysilylpropyl-1-(propyl-3-sulfonate) on mesoporous silica SBA-15; at 120 ℃; for 3h; Reagent/catalyst;

DOI:10.1039/c4ra03531c

Reference yield: 93.7%

styrene (100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6) + o-xylene (95-47-6) → 1,2-dimethyl-2-(1-phenylethyl)benzene (81749-28-2)

Guidance literature:

With divinylbenzene cross-linked sulfonic acid- trifluoromethanesulfonic acid ternary mesoporous poly ionic liquid; at 120 ℃; for 3h; Temperature; Catalytic behavior;

DOI:10.1002/aoc.5180

Reference yield:

o-xylene (95-47-6) + 1-Phenylethanol (98-85-1,13323-81-4) → 1,2-dimethyl-2-(1-phenylethyl)benzene (81749-28-2) + 1,2-dimethyl-4-(1-phenylethyl)benzene (6196-95-8)

Guidance literature:

With iron(III) chloride; at 80 ℃; for 24h;

DOI:10.1002/anie.200462522

upstream raw materials:

styrene

o-xylene

1-Phenylethanol

Refernces

• 1、 Sheng, Xiaoli,Zhou, Yuming,Yang, Yongle,Zhang, Yiwei,Zhang, Zewu,Zhou, Shijian,Fu, Xiaoqin,Zhao, Shuo. "Synthesis of immobilized heteropolyanion-based ionic liquids on mesoporous silica SBA-15 as a heterogeneous catalyst for alkylation". . p. 30697 - 30703. Retrieved 2014/08/05.
• 2、 Xiao, Ya-Ping,Liu, Xin-Yuan,Che, Chi-Ming. "Highly efficient gold(III)-catalyzed intermolecular hydroarylation of unactivated alkenes with arenes under mild conditions". experimental part. p. 494 - 501. Retrieved 2009/06/06.