5-Bromo-3-fluoro-2-methoxyaniline

Base Information

• Chemical Name: 5-Bromo-3-fluoro-2-methoxyaniline
• CAS No.: 239122-51-1
• Molecular Formula: C7H7BrFNO
• Molecular Weight: 220.041
• Hs Code.: 2922190090
• DSSTox Substance ID: DTXSID90697423
• Wikidata: Q82627320
• Mol file: 239122-51-1.mol

Synonyms:5-BROMO-3-FLUORO-2-METHOXYANILINE;239122-51-1;SCHEMBL2309487;DTXSID90697423;IRAJTRFSBJFFGT-UHFFFAOYSA-N;MFCD11847600;AKOS016008255;SB80390;AS-10104;CS-0054201;H11184

Chemical Property of 5-Bromo-3-fluoro-2-methoxyaniline

Chemical Property:

• PSA: 35.25000
• LogP: 2.76020
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 218.96950
• Heavy Atom Count: 11
• Complexity: 136

Purity/Quality:

99% ^*data from raw suppliers

5-Bromo-3-fluoro-2-methoxyaniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1F)Br)N

Technology Process of 5-Bromo-3-fluoro-2-methoxyaniline

There total 1 articles about 5-Bromo-3-fluoro-2-methoxyaniline 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: 82.0%

bromo-4 fluoro-2 nitro-6 anisole (74266-66-3) → 5-bromo-3-fluoro-2-methoxyaniline (239122-51-1)

Guidance literature:

With ammonium chloride; zinc; In ethanol; water; at 20 - 80 ℃; for 2.16667h;

Reference yield: 96.0%

5-bromo-3-fluoro-2-methoxyaniline (239122-51-1) + chloral hydrate (302-17-0) → N-(5-bromo-3-fluoro-2-methoxy-phenyl)-2-[(E)-hydroxyimino]-acetamide (1616831-12-9)

Guidance literature:

With hydrogenchloride; hydroxylamine hydrochloride; sodium sulfate; In 1,4-dioxane; water; at 50 - 70 ℃; for 15h;

Reference yield: 76.0%

5-bromo-3-fluoro-2-methoxyaniline (239122-51-1) + n-propanesulfonyl chloride (10147-36-1) → N-(5-bromo-3-fluoro-2-methoxyphenyl)propane-1-sulfonamide

Guidance literature:

With pyridine; at 20 ℃; for 48h;

upstream raw materials:

bromo-4 fluoro-2 nitro-6 anisole

Downstream raw materials:

C₈H₅BrFNOS

3-amino-5-fluoro-4-methoxybenzonitrile

N-(5-bromo-3-fluoro-2-methoxy-phenyl)-2-[(E)-hydroxyimino]-acetamide

6-fluoro-4-(4-fluorophenyl)-7-methoxyindoline-2,3-dione