3-Fluoro-4-methoxyphenacyl bromide

Base Information

• Chemical Name: 3-Fluoro-4-methoxyphenacyl bromide
• CAS No.: 350-27-6
• Molecular Formula: C9H8BrFO2
• Molecular Weight: 247.064
• Hs Code.: 2914790090
• DSSTox Substance ID: DTXSID80427655
• Nikkaji Number: J865.731I
• Wikidata: Q82240307
• Mol file: 350-27-6.mol

Synonyms:3-Fluoro-4-methoxyphenacyl bromide;350-27-6;2-bromo-1-(3-fluoro-4-methoxyphenyl)ethanone;2-bromo-1-(3-fluoro-4-methoxyphenyl)ethan-1-one;SCHEMBL773681;DTXSID80427655;GUEJEXCTWVCAGC-UHFFFAOYSA-N;MFCD00466240;STL581732;AKOS000210404;PS-9940;CS-0117083;3'-Fluoro-4'-methoxy-alpha-bromoacetophenone;E89218;2-bromo-1-(4-methoxy-3-fluoro-phenyl)ethanone;2-bromo-1-(3-fluoro-4-methoxy-phenyl)ethan-1-one

Chemical Property of 3-Fluoro-4-methoxyphenacyl bromide

Chemical Property:

• Melting Point: 71-74
• PSA: 26.30000
• LogP: 2.41190
• Storage Temp.: Keep Cold
• Sensitive.: Lachrymatory
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 245.96917
• Heavy Atom Count: 13
• Complexity: 187

Purity/Quality:

98%Min ^*data from raw suppliers

2-Bromo-1-(3-fluoro-4-methoxyphenyl)ethanone ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C(=O)CBr)F

Technology Process of 3-Fluoro-4-methoxyphenacyl bromide

There total 5 articles about 3-Fluoro-4-methoxyphenacyl bromide 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%

1-fluoro-2-methoxybenzene (321-28-8) + 2-Bromoacetyl bromide (598-21-0) → 2-bromo-1-(3-fluoro-4-methoxyphenyl)ethanone (350-27-6)

Guidance literature:

With aluminium trichloride; In 1,2-dichloro-ethane; for 4h; Ambient temperature;

DOI:10.3987/com-97-7820

Reference yield: 82.0%

1-(3-fluoro-4-methoxyphenyl)ethanone (455-91-4) → 2-bromo-1-(3-fluoro-4-methoxyphenyl)ethanone (350-27-6)

Guidance literature:

With copper(ll) bromide; In chloroform; ethyl acetate; for 4.5h; Heating / reflux;

Reference yield: 70.0%

→ 2-bromo-1-(3-fluoro-4-methoxyphenyl)ethanone (350-27-6)

Guidance literature:

With bromine; In chloroform; at 0 ℃; for 4h;

upstream raw materials:

1-(3-fluoro-4-methoxyphenyl)ethanone

1-fluoro-2-methoxybenzene

2-Bromoacetyl bromide

Downstream raw materials:

2-(3-fluoro-4-methoxy-phenyl)-7-methyl-indolizine

(4-ethoxy-phenyl)-[5-(3-fluoro-4-methoxy-phenyl)-thiazol-2-yl]-amine

2-Amino-4-<3-fluor-4-methoxyphenyl>-thiazol

[5-(3-fluoro-4-methoxy-phenyl)-thiazol-2-yl]-(2-methoxy-phenyl)-amine

Refernces

• 1、 -. "ANTIBACTERIAL COMPOUNDS". Page/Page column 79-80; 84-85. . Retrieved 2019/05/22.
• 2、 -. "RAF INHIBITORS AND THEIR USES". Page/Page column 65. . Retrieved 2008/06/13.