2-Bromo-4-fluoro-6-nitrophenol

Base Information

• Chemical Name: 2-Bromo-4-fluoro-6-nitrophenol
• CAS No.: 320-75-2
• Molecular Formula: C6H3 Br F N O3
• Molecular Weight: 235.997
• Hs Code.: 2908999090
• European Community (EC) Number: 807-839-9
• DSSTox Substance ID: DTXSID50378423
• Wikidata: Q82167928
• Mol file: 320-75-2.mol

Synonyms:2-bromo-4-fluoro-6-nitrophenol;320-75-2;6-bromo-4-fluoro-2-nitrophenol;2-bromo-4-fluoro-6-nitro-phenol;SCHEMBL103118;DTXSID50378423;DFHGOCSWFGXYSQ-UHFFFAOYSA-N;MFCD03094182;AKOS001341787;PS-10576;CS-0036370;FT-0631948;EN300-26643;W11571;A821120;Z227832744

Chemical Property of 2-Bromo-4-fluoro-6-nitrophenol

Chemical Property:

• Vapor Pressure: 0.0271mmHg at 25°C
• Melting Point: 67°C
• Refractive Index: 1.623
• Boiling Point: 238.7°Cat760mmHg
• PKA: 5.01±0.38(Predicted)
• Flash Point: 98.2°C
• PSA: 66.05000
• Density: 1.965g/cm³
• LogP: 2.72520
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 234.92803
• Heavy Atom Count: 12
• Complexity: 186

Purity/Quality:

98%min ^*data from raw suppliers

2-Bromo-4-fluoro-6-nitrophenol ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)Br)F

Technology Process of 2-Bromo-4-fluoro-6-nitrophenol

There total 4 articles about 2-Bromo-4-fluoro-6-nitrophenol 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: 97.0%

→ 2-bromo-4-fluoro-6-nitrophenol (320-75-2)

Guidance literature:

Reference yield: 80.8%

2-bromo-4-fluoro-phenol (496-69-5) → 2-bromo-4-fluoro-6-nitrophenol (320-75-2)

Guidance literature:

With sodium nitrate; sulfuric acid; In water; at 20 ℃; Cooling with ice;

Reference yield:

2,6-dibromo-4-fluorophenol (344-20-7) → 2-bromo-4-fluoro-6-nitrophenol (320-75-2)

Guidance literature:

With acetic acid; sodium nitrite; at 14 - 18 ℃;

DOI:10.1021/ja01239a020

upstream raw materials:

2,6-dibromo-4-fluorophenol

acetic acid

2-bromo-4-fluoro-phenol

Downstream raw materials:

8-bromo-6-fluoro-4H-benzo[1,4]oxazin-3-one

1-bromo-5-fluoro-2-(methyloxy)-3-nitrobenzene

2-amino-6-bromo-4-fluorophenol

Refernces

• 1、 -. "NOVEL ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS". Page/Page column 136. . Retrieved 2008/06/13.