1-(2',4',6'-Trichlorophenyl)-3-(2'-chloro-5'-aminoanilino)-5-pyrazolone

Base Information

• Chemical Name: 1-(2',4',6'-Trichlorophenyl)-3-(2'-chloro-5'-aminoanilino)-5-pyrazolone
• CAS No.: 86491-51-2
• Molecular Formula: C15H10Cl4N4O
• Molecular Weight: 404.08
• DSSTox Substance ID: DTXSID60360339
• Wikidata: Q72510346
• Mol file: 86491-51-2.mol

Synonyms:86491-51-2;1-(2',4',6'-Trichlorophenyl)-3-(2'-chloro-5'-aminoanilino)-5-pyrazolone;3-(5-Amino-2-chloroanilino)-1-(2,4,6-trichlorophenyl)-5-pyrazolone;1-(2,4,6-Trichlorophenyl)-3-(2-chloro-5-aminoanilino)-5-pyrazolone;5-(5-amino-2-chloroanilino)-2-(2,4,6-trichlorophenyl)-1H-pyrazol-3-one;Oprea1_208751;Oprea1_728997;SCHEMBL10386122;DTXSID60360339;WWMPJJGEDOGFQV-UHFFFAOYSA-N;CCG-2801;STK332216;AKOS000746697;AKOS015896123;FT-0642043;W-111070;3-(5-AMINO-2-CHLOROANILINO)-1-(2,4,6-TRICHLOROPHENYL)-1H-PYRAZOL-5-OL;3-[(5-amino-2-chlorophenyl)amino]-1-(2,4,6-trichlorophenyl)-1H-pyrazol-5-ol;5-(5-amino-2-chlorophenylamino)-2-(2,4,6-trichlorophenyl)-1H-pyrazol-3(2H)-one

Chemical Property of 1-(2',4',6'-Trichlorophenyl)-3-(2'-chloro-5'-aminoanilino)-5-pyrazolone

Chemical Property:

• Boiling Point: 545.4 °C at 760 mmHg
• Flash Point: 283.6 °C
• PSA: 75.84000
• Density: 1.68 g/cm³
• LogP: 5.75920
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 403.957922
• Heavy Atom Count: 24
• Complexity: 508

Purity/Quality:

99% ^*data from raw suppliers

1-(2',4',6'-TRICHLOROPHENYL)-3-(2'-CHLORO-5'-AMINOANILINO)-5-PYRAZOLONE 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=C1N)NC2=CC(=O)N(N2)C3=C(C=C(C=C3Cl)Cl)Cl)Cl