4-Bromo-2,6-dimethylaniline

Base Information

• Chemical Name: 4-Bromo-2,6-dimethylaniline
• CAS No.: 24596-19-8
• Molecular Formula: C8H10BrN
• Molecular Weight: 200.078
• Hs Code.: 29214990
• European Community (EC) Number: 246-337-9
• NSC Number: 227944
• UNII: 9W5K8J5F6B
• DSSTox Substance ID: DTXSID40179345
• Nikkaji Number: J236.723H
• Wikidata: Q63398931
• Mol file: 24596-19-8.mol

Synonyms:4-Bromo-2,6-dimethylaniline;24596-19-8;4-Bromo-2,6-xylidine;Benzenamine, 4-bromo-2,6-dimethyl-;4-Bromo-2,6-dimethyl-phenylamine;4-bromo-2,6-dimethylphenylamine;2,6-Dimethyl-4-bromoaniline;4-bromo-2,6-dimethylbenzenamine;9W5K8J5F6B;(4-bromo-2,6-dimethylphenyl)amine;EINECS 246-337-9;NSC-227944;4-bromo-2,6-dimethyl-aniline;NSC227944;Nc1c(C)cc(Br)cc1C;2,6-Xylidine, 4-bromo-;4-Bromo-2,6dimethylaniline;UNII-9W5K8J5F6B;SCHEMBL146892;4-bromo-2,6-di-methylaniline;DTXSID40179345;4-bromo-2,6-dimethyl phenylamine;CL4142;MFCD00007826;STK345441;4-Bromo-2,6-dimethylaniline, 98%;AKOS000111247;AC-3649;CS-W019870;NSC 227944;PS-6202;SB77433;AM20030446;B1909;BB 0243357;FT-0617743;EN300-31727;A930322;AN-652/40879414;W-107297;Q63398931;Z335243396;4-Bromo-2,6-dimethylphenylamine (4-Bromo-2,6-dimethylaniline;4-Bromo-2,6-xylidine)

Chemical Property of 4-Bromo-2,6-dimethylaniline

Chemical Property:

• Appearance/Colour: brown crystals
• Vapor Pressure: 0.0134mmHg at 25°C
• Melting Point: 48-51 °C(lit.)
• Refractive Index: 1.596
• Boiling Point: 258.8 °C at 760 mmHg
• PKA: 3.60±0.10(Predicted)
• Flash Point: 110.3 °C
• PSA: 26.02000
• Density: 1.424 g/cm³
• LogP: 3.22930
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• Solubility.: Chloroform, Methanol
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 198.99966
• Heavy Atom Count: 10
• Complexity: 104

Purity/Quality:

99%, ^*data from raw suppliers

4-Bromo-2,6-xylidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,Xi
• Hazard Codes: Xi,Xn
• Statements: 38-43-36/37/38-20/21/22
• Safety Statements: 36/37-36/37/39-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1N)C)Br
• Uses: 4-Bromo-2,6-dimethylaniline has been used in the preparation of:4-bromo-N-(1-(6-(1-isopropyl-1H-benzo[d]imidazol-2-yl)pyridin-2-yl)ethylidene)-2,6-dimethylbenzenamineN-(4-Bromo-2,6-dimethylphenyl)-5-trimethylammoniumsalicylaldimine chlorideethynyl-functionalized persistent perylene diimide-multichromophore

Technology Process of 4-Bromo-2,6-dimethylaniline

There total 6 articles about 4-Bromo-2,6-dimethylaniline 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: 98.2%

2,6-dimethylaniline (87-62-7) → 4-bromo-2,6-dimethylphenylamine (24596-19-8)

Guidance literature:

With HMTAB; In dichloromethane; at 20 ℃;

DOI:10.1016/j.tetlet.2005.10.041

Reference yield: 64.0%

2-(4-bromo-2,6-dimethylphenoxy) propanamide (882642-83-3) → 4-bromo-2,6-dimethylphenylamine (24596-19-8)

Guidance literature:

With potassium hydroxide; In dimethyl sulfoxide; at 140 ℃; for 8h; Green chemistry;

DOI:10.1016/j.tetlet.2013.04.028

Reference yield:

N-(2,6-dimethylphenyl)hydroxylamine (3096-63-7) → 4-bromo-2,6-dimethylphenylamine (24596-19-8) + 3,5-dimethyl-4-aminophenol (3096-70-6) + 2,6-dimethylaniline (87-62-7)

Guidance literature:

With perchloric acid; sodium perchlorate; sodium bromide; In water; acetonitrile; at 25 ℃; Rate constant;

DOI:10.1139/v96-147

upstream raw materials:

2,6-dimethylaniline

N-(2,6-dimethylphenyl)hydroxylamine

hydrogenchloride

bromine

Downstream raw materials:

N-(4-Bromo-2,6-dimethyl-phenyl)-N'-[1-nitro-eth-(Z)-ylidene]-hydrazine

4-bromo-2,6-dimethyl-phenol

2-[(4-Bromo-2,6-dimethyl-phenyl)-(3-chloro-propionyl)-amino]-thiopropionic acid S-methyl ester

trans-3-(4-amino-3,5-dimethylphenyl)acrylonitrile

Refernces

• 1、 -. "Preparation method of halogen-substituted alkylaniline". Paragraph 0040-0042. . Retrieved 2020/05/02.
• 2、 -. "Aryl halide and synthesis method and application thereof". Paragraph 0085-0087. . Retrieved 2020/06/02.