2,4,6-trimethyl-1H-indene

Base Information

• Chemical Name: 2,4,6-trimethyl-1H-indene
• CAS No.: 150096-40-5
• Molecular Formula: C12H14
• Molecular Weight: 158.243
• Hs Code.: 2902909090
• DSSTox Substance ID: DTXSID90448316
• Nikkaji Number: J1.888.212D
• Wikidata: Q72514100
• Mol file: 150096-40-5.mol

Synonyms:2,4,6-trimethyl-1H-indene;150096-40-5;1H-Indene, 2,4,6-trimethyl-;2,4,6-Trimethylindene;2,4,6-trimethyl-indene;DTXSID90448316;OSNBXQPGMJVNOI-UHFFFAOYSA-N;AKOS006328101;A884200

Chemical Property of 2,4,6-trimethyl-1H-indene

Chemical Property:

• Boiling Point: 244℃
• Flash Point: 96℃
• PSA: 0.00000
• Density: 0.974
• LogP: 3.26280
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 158.109550447
• Heavy Atom Count: 12
• Complexity: 202

Purity/Quality:

97% ^*data from raw suppliers

2,4,6-Trimethyl-1H-indene 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C(C=C2C1)C)C

Technology Process of 2,4,6-trimethyl-1H-indene

There total 8 articles about 2,4,6-trimethyl-1H-indene 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: 96.0%

2,5,7-trimethyl-indan-1-one (65001-59-4) → 1-indene (95-13-6) + 2,4,6-trimethyl-indene (150096-40-5)

Guidance literature:

With sodium tetrahydroborate; magnesium sulfate; In tetrahydrofuran; methanol;

Reference yield: 77.0%

m-xylene (108-38-3,104809-90-7) + Methacryloyl chloride (920-46-7,26937-45-1) → 2,4,6-trimethyl-indene (150096-40-5)

Guidance literature:

m-xylene; Methacryloyl chloride; With aluminium trichloride; In dichloromethane; for 3h; Heating;

With sodium tetrahydroborate; In tetrahydrofuran; methanol;

With toluene-4-sulfonic acid; In benzene; for 3h; Heating;

DOI:10.1016/j.jorganchem.2004.10.052

Reference yield: 71.0%

2,5,7-trimethyl-indan-1-one (65001-59-4) → 2,4,6-trimethyl-indene (150096-40-5)

Guidance literature:

2,5,7-trimethyl-indan-1-one; With sodium tetrahydroborate; In tetrahydrofuran; methanol; at 20 ℃; for 24h;

With phosphorus pentoxide; In benzene; for 1h; Heating;

DOI:10.1016/j.jorganchem.2004.10.052

upstream raw materials:

2,5,7-trimethyl-indan-1-one

m-xylene

Methacryloyl chloride

β-(3,5-dimethylphenyl)-α-methylpropionic acid