(2-Aminophenyl)(4-fluorophenyl)methanone methanesulfonate

Base Information

• Chemical Name: (2-Aminophenyl)(4-fluorophenyl)methanone methanesulfonate
• CAS No.: 449181-32-2
• Molecular Formula: CH₄O₃S*C₁₃H₁₀FNO
• Molecular Weight: 311.334
• Hs Code.: 2922399090
• DSSTox Substance ID: DTXSID90703376
• Mol file: 449181-32-2.mol

Synonyms:449181-32-2;(2-Aminophenyl)(4-fluorophenyl)methanone methanesulfonate;SCHEMBL756920;2-AMINO-4'-FLUOROBENZOPHENONE METHANESULFONATE;DTXSID90703376;NTRZJJUYWMYMHI-UHFFFAOYSA-N;SB83105;FT-0696451;4-fluoro-2'-aminobenzophenone methansulfonic acid salt;(2-Aminophenyl)(4-fluorophenyl)methanonemethanesulfonate;Methanone,(2-aminophenyl)(4-fluorophenyl)-,methanesulfonate(9ci);Methanesulfonic acid--(2-aminophenyl)(4-fluorophenyl)methanone (1/1)

Chemical Property of (2-Aminophenyl)(4-fluorophenyl)methanone methanesulfonate

Chemical Property:

• PSA: 105.84000
• LogP: 3.80490
• Storage Temp.: Sealed in dry,Room Temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 311.06275726
• Heavy Atom Count: 21
• Complexity: 341

Purity/Quality:

98.0%Min ^*data from raw suppliers

(2-Aminophenyl)(4-fluorophenyl)methanonemethanesulfonate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CS(=O)(=O)O.C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)F)N

Technology Process of (2-Aminophenyl)(4-fluorophenyl)methanone methanesulfonate

There total 1 articles about (2-Aminophenyl)(4-fluorophenyl)methanone methanesulfonate 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: 86.0%

fluorobenzene (462-06-6) + methanesulfonic acid (75-75-2,98527-29-8) + 2-(toluene-4-sulfonylamino)-benzoic acid (6311-23-5) → 4-Fluoro-2'-aminobenzophenone methansulfonic acid salt (449181-32-2)

Guidance literature:

2-(toluene-4-sulfonylamino)-benzoic acid; With thionyl chloride; N,N-dimethyl-formamide; In 1,2-dichloro-benzene; at 80 ℃;

fluorobenzene; With aluminum (III) chloride; In 1,2-dichloro-benzene; at 20 - 90 ℃; for 3h;

methanesulfonic acid; In ethyl acetate;

upstream raw materials:

fluorobenzene

methanesulfonic acid

2-(toluene-4-sulfonylamino)-benzoic acid

Refernces