2,3-Difluoro-6-(trifluoromethyl)aniline

Base Information

• Chemical Name: 2,3-Difluoro-6-(trifluoromethyl)aniline
• CAS No.: 124185-34-8
• Molecular Formula: C7H4 F5 N
• Molecular Weight: 197.11
• Hs Code.: 2921420090
• DSSTox Substance ID: DTXSID50575753
• Wikidata: Q82465171
• Mol file: 124185-34-8.mol

Synonyms:2,3-difluoro-6-(trifluoromethyl)aniline;124185-34-8;2,3-Difluoro-6-trifluoromethyl-phenylamine;Benzenamine, 2,3-difluoro-6-(trifluoromethyl)-;SCHEMBL2749699;DTXSID50575753;MFCD07777167;2,3-Difluoro-6-trifluoromethylaniline;2-amino-3,4-difluoro-benzotrifluoride;AKOS006344019;BS-53309;CS-0443096

Chemical Property of 2,3-Difluoro-6-(trifluoromethyl)aniline

Chemical Property:

• Vapor Pressure: 1.44mmHg at 25°C
• Refractive Index: 1.443
• Boiling Point: 170.9°C at 760 mmHg
• Flash Point: 67.5°C
• PSA: 26.02000
• Density: 1.474g/cm³
• LogP: 3.14700
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 197.02638994
• Heavy Atom Count: 13
• Complexity: 180

Purity/Quality:

98%min ^*data from raw suppliers

2,3-Difluoro-6-trifluoromethylaniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R20/21/22-36/37/38:
• Hazard Codes: R20/21/22-36/37/38:
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1C(F)(F)F)N)F)F
• Uses: 2,3-Difluoro-6-trifluoromethylaniline is a starting material and useful building block of various pharmaceuticals.

Technology Process of 2,3-Difluoro-6-(trifluoromethyl)aniline

There total 2 articles about 2,3-Difluoro-6-(trifluoromethyl)aniline 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:

2,3,4-Trifluoro-trifluoromethylbenzene (393-01-1) → 2-amino-3,4-difluoro-benzotrifluoride (124185-34-8)

Guidance literature:

With ammonia; In tetrahydrofuran;

Reference yield:

2,3,4-Trifluoro-trifluoromethylbenzene (393-01-1) → 2,3-difluoro-4-trifluoromethyl-phenylamine (123950-46-9) + 2-amino-3,4-difluoro-benzotrifluoride (124185-34-8)

Guidance literature:

With ammonia; In tetrahydrofuran;

upstream raw materials:

2,3,4-Trifluoro-trifluoromethylbenzene

Refernces

• 1、 -. "Fungicidal 3-cyano-4-phenyl-pyrrole derivatives". . . Retrieved 2008/06/13.