2-(2-Fluorophenoxy)aniline

Base Information

• Chemical Name: 2-(2-Fluorophenoxy)aniline
• CAS No.: 391906-76-6
• Molecular Formula: C12H10FNO
• Molecular Weight: 203.216
• European Community (EC) Number: 692-807-5
• DSSTox Substance ID: DTXSID10589735
• Nikkaji Number: J1.505.397F
• Wikidata: Q82483283
• Mol file: 391906-76-6.mol

Synonyms:2-(2-fluorophenoxy)aniline;391906-76-6;fluoro-2'-aminodiphenyl ether;SCHEMBL1341090;DTXSID10589735;FMHXQFVNBSTBQV-UHFFFAOYSA-N;AMY15041;STK501050;AKOS000100570;SB76953;CS-0327472;C78189

Chemical Property of 2-(2-Fluorophenoxy)aniline

Chemical Property:

• Vapor Pressure: 0.006mmHg at 25°C
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 203.074642105
• Heavy Atom Count: 15
• Complexity: 200

Purity/Quality:

98%min ^*data from raw suppliers

2-(2-Fluorophenoxy)aniline ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)N)OC2=CC=CC=C2F

Technology Process of 2-(2-Fluorophenoxy)aniline

There total 4 articles about 2-(2-Fluorophenoxy)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: 100.0%

1-fluoro-2- (2-nitrophenoxy)benzene (93974-08-4) → 2-(2-fluorophenoxy)aniline (391906-76-6)

Guidance literature:

With hydrogenchloride; acetic acid; zinc; In water; ethyl acetate; at 0 - 20 ℃; for 1h;

DOI:10.1002/chem.201402961

Reference yield:

2-fluorophenol (367-12-4) → 2-(2-fluorophenoxy)aniline (391906-76-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 74 percent / copper(I) oxide; pyridine / 12 h / Heating

2: 92 percent / HCl; iron / ethanol / 6 h / Heating

With pyridine; copper(I) oxide; hydrogenchloride; iron; In ethanol;

DOI:10.1021/jo060911c

Reference yield:

2-Chloronitrobenzene (88-73-3) → 2-(2-fluorophenoxy)aniline (391906-76-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 63 percent / KOH / 2.5 h / 110 - 120 °C

2: 87 percent / H₂ / Pd/C / methanol / 12 h / 20 °C

With potassium hydroxide; hydrogen; palladium on activated charcoal; In methanol;

DOI:10.1055/s-2001-18103

upstream raw materials:

1-fluoro-2- (2-nitrophenoxy)benzene

2-fluorophenol

2-Chloronitrobenzene

Downstream raw materials:

phenoxazine

2-fluorophenyl 2-iodophenyl ether

Refernces

• 1、 -. "Pyrazinamide compounds, preparation method and application thereof as well as bactericide". Paragraph 0143; 0171; 0172. . Retrieved 2018/06/04.
• 2、 Tietze, Lutz F.,Eichhorst, Christoph,Hungerland, Tim,Steinert, Markus. "A Fast Way to Fluorescence: A Fourfold Domino Reaction to Condensed Polycyclic Compounds". supporting information. p. 12553 - 12558. Retrieved 2016/08/25.