1,3,5-Trimethyl-2-(1-phenylethyl)benzene

Base Information

• Chemical Name: 1,3,5-Trimethyl-2-(1-phenylethyl)benzene
• CAS No.: 2027-16-9
• Molecular Formula: C₁₇H₂₀
• Molecular Weight: 224.346
• DSSTox Substance ID: DTXSID10531815
• Nikkaji Number: J3.113.492G
• Mol file: 2027-16-9.mol

Synonyms:1,3,5-Trimethyl-2-(1-phenylethyl)benzene;2027-16-9;1-mesityl-1-phenylethane;DTXSID10531815

Chemical Property of 1,3,5-Trimethyl-2-(1-phenylethyl)benzene

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 224.156500638
• Heavy Atom Count: 17
• Complexity: 214

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C(=C1)C)C(C)C2=CC=CC=C2)C

Technology Process of 1,3,5-Trimethyl-2-(1-phenylethyl)benzene

There total 13 articles about 1,3,5-Trimethyl-2-(1-phenylethyl)benzene 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: 99.0%

1-phenyl-1-trimethylsilyloxyethane (14856-75-8) + 1,3,5-trimethyl-benzene (108-67-8) → 1,3,5-trimethyl-2-(1-phenylethyl)benzene (32189-56-3,2027-16-9)

Guidance literature:

With iron(III) chloride; In 1,2-dichloro-ethane; at 20 ℃; for 6h; regioselective reaction; Inert atmosphere;

DOI:10.1002/chem.201302862

Reference yield: 98.0%

acetophenone (98-86-2) + 1,3,5-trimethyl-benzene (108-67-8) → 1,3,5-trimethyl-2-(1-phenylethyl)benzene (32189-56-3,2027-16-9)

Guidance literature:

With trifluorormethanesulfonic acid; hydrogen; C₂₃H₂₄ClIrN₄; at 80 ℃; under 760.051 Torr;

DOI:10.1021/acscatal.1c00740

Reference yield: 92.0%

1-Phenylethanol (98-85-1,13323-81-4) + 1,3,5-trimethyl-benzene (108-67-8) → 1,3,5-trimethyl-2-(1-phenylethyl)benzene (32189-56-3,2027-16-9)

Guidance literature:

With [Fe(α,β,γ,δ-mesotetraphenylporphyrinate)]SbF6; In 1,2-dichloro-ethane; at 80 ℃; for 5h; Sealed tube; Inert atmosphere;

DOI:10.1055/s-0033-1339640

upstream raw materials:

1-mesityl-1-phenylethene

phenylacetylene

1,3,5-trimethyl-benzene

ethanol