2,6-Dibromo-4-tert-butylaniline

Base Information

• Chemical Name: 2,6-Dibromo-4-tert-butylaniline
• CAS No.: 10546-67-5
• Molecular Formula: C10H13 Br2 N
• Molecular Weight: 307.028
• Hs Code.: 2921420090
• European Community (EC) Number: 696-204-8
• DSSTox Substance ID: DTXSID10375594
• Nikkaji Number: J963.489D
• Mol file: 10546-67-5.mol

Synonyms:2,6-dibromo-4-tert-butylaniline;10546-67-5;2,6-Dibromo-4-(tert-butyl)aniline;MFCD06657952;SCHEMBL1542675;DTXSID10375594;FEHTXNYXDWPZCQ-UHFFFAOYSA-N;AKOS015835096;AS-20143;SY063905;CS-0036975;2,6-Dibromo-4-(1,1-dimethylethyl)benzenamine;W11581;A895999

Chemical Property of 2,6-Dibromo-4-tert-butylaniline

Chemical Property:

• Boiling Point: 288℃
• PKA: 0.80±0.10(Predicted)
• Flash Point: 128℃
• PSA: 26.02000
• Density: 1.609
• LogP: 4.67250
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 306.93943
• Heavy Atom Count: 13
• Complexity: 164

Purity/Quality:

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

2,6-Dibromo-4-tert-butylaniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1=CC(=C(C(=C1)Br)N)Br
• Uses: 2,6-Dibromo-4-tert-butylaniline

Technology Process of 2,6-Dibromo-4-tert-butylaniline

There total 3 articles about 2,6-Dibromo-4-tert-butylaniline 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: 99.6%

4-tert-Butylaniline (769-92-6) → 2,6-dibromo-4-(tert-butyl)aniline (10546-67-5)

Guidance literature:

With bromine; In methanol; dichloromethane; at 20 ℃; for 24h;

Reference yield:

4-tert-Butylaniline (769-92-6) → 2-bromo-4-tert-butylaniline (103273-01-4) + 2,6-dibromo-4-(tert-butyl)aniline (10546-67-5)

Guidance literature:

With hydrogen bromide; dihydrogen peroxide; In water; at 20 ℃; for 24h; Darkness;

DOI:10.1016/j.tet.2009.03.034

Reference yield:

2-bromo-4-tert-butylaniline (103273-01-4) → 2,6-dibromo-4-(tert-butyl)aniline (10546-67-5)

Guidance literature:

With bromine; acetic acid;

DOI:10.1021/ja01212a070

upstream raw materials:

2-bromo-4-tert-butylaniline

4-tert-Butylaniline

Downstream raw materials:

1,3-dibromo-5-t-butylbenzene

1,3-dibromo-5-(tert-butyl)-2-iodobenzene

4-tert-butyl-2,6-di(phenyl-d5)aniline

4,4''''-bis(but-3-en-1-yloxy)-5''-tert-butyl-1,1':4',1'':3'',1''':4''',1''''-quinquephenyl-2''-amine

Refernces

• 1、 Guo, Zhengqing,Yiu, Shek-Man,Chan, Michael C. W.. "Shape-persistent (Pt-salphen)2 phosphorescent coordination frameworks: Structural insights and selective perturbations". . p. 8937 - 8947. Retrieved 2013.
• 2、 -. "Organic light-emitting material based on platinum quadridentate ONCN complex, preparation method, and application of the same in organic light emitting diodes (OLEDs)". Paragraph 0142-0144. . Retrieved 2020/03/17.
• 3、 -. "ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANOMETALLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE". Paragraph 0092-0094. . Retrieved 2019/06/20.