3-(2,4-Dichloro-5-fluorophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde

Base Information

• Chemical Name: 3-(2,4-Dichloro-5-fluorophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde
• CAS No.: 618098-87-6
• Molecular Formula: C16H9Cl2FN2O
• Molecular Weight: 335.165
• Hs Code.: 2933199090
• European Community (EC) Number: 649-919-4
• Mol file: 618098-87-6.mol

Synonyms:3-(2,4-DICHLORO-5-FLUOROPHENYL)-1-PHENYL-1H-PYRAZOLE-4-CARBALDEHYDE;618098-87-6;AKOS024412160

Chemical Property of 3-(2,4-Dichloro-5-fluorophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde

Chemical Property:

• PSA: 34.89000
• LogP: 4.79770
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 334.0075965
• Heavy Atom Count: 22
• Complexity: 394

Purity/Quality:

99% ^*data from raw suppliers

3-(2,4-DICHLORO-5-FLUOROPHENYL)-1-PHENYL-1H-PYRAZOLE-4-CARBALDEHYDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=C(C=C3Cl)Cl)F)C=O

Technology Process of 3-(2,4-Dichloro-5-fluorophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde

There total 1 articles about 3-(2,4-Dichloro-5-fluorophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde 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:

2,4-dichloro-5-fluoroacetophenone (704-10-9) + N,N-dimethyl-formamide (68-12-2,33513-42-7) + phenylhydrazine (100-63-0) → 3-(2,4-dichloro-5-fluoro-phenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde (618098-87-6)

Guidance literature:

With trichlorophosphate; In N,N-dimethyl-formamide; at 20 - 70 ℃; for 5h;

DOI:10.1515/HC.2004.10.4-5.331

Reference yield: 89.0%

morpholine (110-91-8,99108-56-2) + phenylacetylene (536-74-3) + 3-(2,4-dichloro-5-fluoro-phenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde (618098-87-6) → 4-[1-(3-(2,4-dichloro-5-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl)-3-phenylprop-2-ynyl]morpholine

Guidance literature:

With Nanocat-Fe-CuO MNPs (iron oxide-supported copper oxide nanocatalyst); In toluene; at 145 ℃; for 23h; Sealed tube; Reflux;

DOI:10.1007/s11164-015-2319-4

Reference yield: 86.0%

3-trifluoromethyl-1-phenyl-1H-pyrazol-5(4H)-one (781-93-1) + 3-(2,4-dichloro-5-fluoro-phenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde (618098-87-6) → C26H14Cl2F4N4O

Guidance literature:

With acetic acid; for 0.166667h; sonication;

upstream raw materials:

2,4-dichloro-5-fluoroacetophenone

N,N-dimethyl-formamide

phenylhydrazine

Downstream raw materials:

3-(2,4-dichloro-5-fluoro-phenyl)-1-phenyl-1H-pyrazole-4-carbonitrile

C₃₄H₂₆Cl₂FN₅O

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