2-Amino-6-fluorophenol

Base Information

• Chemical Name: 2-Amino-6-fluorophenol
• CAS No.: 53981-25-2
• Molecular Formula: C6H6FNO
• Molecular Weight: 127.118
• Hs Code.: 2922299090
• European Community (EC) Number: 815-934-1
• DSSTox Substance ID: DTXSID201314610
• Mol file: 53981-25-2.mol

Synonyms:6-Fluoro-2-aminophenol;2-amino-6-fluorophenol;53981-25-2;2-amino-6-fluoro-phenol;3-Fluoro-2-hydroxyaniline;MFCD08532465;2-Amino-6-flourophenol;phenol, 2-amino-6-fluoro-;20027-33-2;SCHEMBL103939;DTXSID201314610;AKOS006338822;AB45742;CS-W003533;PS-9169;SY026828;A7839;AM20050089;FT-0612064;EN300-111693;J-518711;Z1203578717

Chemical Property of 2-Amino-6-fluorophenol

Chemical Property:

• Vapor Pressure: 0.0996mmHg at 25°C
• Refractive Index: 1.601
• Boiling Point: 215.7 °C at 760 mmHg
• PKA: 8.50±0.10(Predicted)
• Flash Point: 84.2 °C
• PSA: 46.25000
• Density: 1.347g/cm³
• LogP: 1.69470
• Storage Temp.: Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 127.043341977
• Heavy Atom Count: 9
• Complexity: 99.1

Purity/Quality:

99% ^*data from raw suppliers

2-Amino-6-fluorophenol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1)F)O)N
• Uses: A metabolite of halogenated aniline.

Technology Process of 2-Amino-6-fluorophenol

There total 2 articles about 2-Amino-6-fluorophenol 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: 87.0%

2-fluoro-6-nitrophenol (1526-17-6,34470-85-4) → 2-amino-6-fluoro phenol (53981-25-2)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In methanol; for 1h;

DOI:10.1016/j.bmcl.2014.05.088

Reference yield: 54.0%

→ 2-amino-6-fluoro phenol (53981-25-2)

Guidance literature:

Reference yield: 97.0%

2-amino-6-fluoro phenol (53981-25-2) + 2-Naphthalenesulfonyl chloride (93-11-8) → N-(3-fluoro-2-hydroxyphenyl)-naphthalene-2-sulfonamide

Guidance literature:

With pyridine; In dichloromethane; at 20 ℃; for 4h;

DOI:10.1021/acs.orglett.0c01490

upstream raw materials:

2-fluoro-6-nitrophenol

Downstream raw materials:

2-(2-bromo-3-methylbutyryl)amino-6-fluorophenol

2-mercapto-7-fluorobenzoxazole

2-chloro-7-fluoro-benzoxazole

8-fluoro-3,4-dihydro-2H-1,4-benzoxazin-3-one

Refernces

• 1、 Rynearson, Kevin D.,Charrette, Brian,Gabriel, Christopher,Moreno, Jesus,Boerneke, Mark A.,Dibrov, Sergey M.,Hermann, Thomas. "2-Aminobenzoxazole ligands of the hepatitis C virus internal ribosome entry site". supporting information. p. 3521 - 3525. Retrieved 2014/07/22.
• 2、 -. "BENZOXAZOLONE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR USES". Page/Page column 25. . Retrieved 2008/06/13.