1,3,5-Tribromo-2,4,6-trimethylbenzene

Base Information

• Chemical Name: 1,3,5-Tribromo-2,4,6-trimethylbenzene
• CAS No.: 608-72-0
• Molecular Formula: C9H9 Br3
• Molecular Weight: 356.882
• European Community (EC) Number: 636-411-2
• NSC Number: 97124
• DSSTox Substance ID: DTXSID40294567
• Nikkaji Number: J134.784E
• Wikidata: Q82033935
• Mol file: 608-72-0.mol

Synonyms:1,3,5-tribromo-2,4,6-trimethylbenzene;608-72-0;2,4,6-tribromo-1,3,5-trimethylbenzene;1,3,5-Tribromo-2,4,6-Trimethyl-Benzene;Tribrommesitylen;2,4,6-Tribromomesitylene;tribromomesitylene;MFCD00155003;NSC97124;YSZC047;SCHEMBL358040;DTXSID40294567;NSC-97124;AKOS024322268;CS-W011835;DS-19253;SY103766;T3516;F20925

Chemical Property of 1,3,5-Tribromo-2,4,6-trimethylbenzene

Chemical Property:

• Vapor Pressure: 0.000342mmHg at 25°C
• Melting Point: 225.5-226.5℃
• Boiling Point: 329.3°C at 760 mmHg
• Flash Point: 149.5°C
• PSA: 0.00000
• Density: 1.91g/cm³
• LogP: 4.89930
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Chloroform (Heated), Hexanes (Slightly, Heated)
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 355.82339
• Heavy Atom Count: 12
• Complexity: 113

Purity/Quality:

98%,99%, ^*data from raw suppliers

1,3,5-Tribromo-2,4,6-Trimethylbenzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=C(C(=C(C(=C1Br)C)Br)C)Br
• Uses: 1,3,5-Tribromo-2,4,6-Trimethylbenzene is a useful reagent for preparing highly durable superhydrophobic nanothorn arrays.

Technology Process of 1,3,5-Tribromo-2,4,6-trimethylbenzene

There total 16 articles about 1,3,5-Tribromo-2,4,6-trimethylbenzene 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%

1,3,5-trimethyl-benzene (108-67-8) → 2,4,6-tribromomesitylene (608-72-0)

Guidance literature:

With benzyltrimethylazanium tribroman-2-uide; zinc(II) chloride; In acetic acid; at 70 ℃; for 24h;

DOI:10.1246/bcsj.62.439

Reference yield:

1,3,5-trimethyl-benzene (108-67-8) → 2,4,6-trimethylphenyl bromide (576-83-0) + 2,4,6-tribromomesitylene (608-72-0) + 2,4-dibromomesitylene (6942-99-0)

Guidance literature:

With Oxone; quartz; sodium bromide; In n-heptane; for 0.333333h; Milling;

DOI:10.1039/c2gc16508b

Reference yield:

2,4,6-trimethylphenyl bromide (576-83-0) + sulfuric acid (7664-93-9) → 2,4,6-tribromomesitylene (608-72-0) + mesitylene sulfonic acid (3453-83-6)

Guidance literature:

at 70 ℃;

DOI:10.1021/ja01292a001

upstream raw materials:

ethylcycloheptane

2,4,6-trimethylphenyl bromide

1,3,5-trimethyl-benzene

bromine

Downstream raw materials:

1,3,5-trimethyl-2,4,6-tris-phenylsulfanyl-benzene

4,6-dibromo-1,2,3,5-tetramethylbenzene

3,3'-dibromo-2,2',4,4',6,6'-hexamethylbiphenyl

1,3,5-tris(bromo)-2,4,6-tris(bromomethyl) benzene

Refernces

• 1、 Chen, Siqi,Li, Zhibo,Pan, Qingyan,Shao, Feng,Sun, Qingzhu,Wu, Chenyu,Zhang, Zhaohui,Zhao, Yingjie. "Interfacial synthesis of crystalline two-dimensional cyano-graphdiyne". supporting information. p. 3210 - 3213. Retrieved 2020/03/23.
• 2、 Yang, Xuejin,Yuan, Luyan,Chen, Ziyi,Liu, Zhifeng,Miao, Qian. "A Trefoil Macrocycle Synthesized by 3-Fold Benzannulation". supporting information. p. 6952 - 6956. Retrieved 2018/11/02.