1-[3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitrophenyl)ethanone

Base Information

• Chemical Name: 1-[3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitrophenyl)ethanone
• CAS No.: 6068-95-7
• Molecular Formula: C18H13BrF3N3O4
• Molecular Weight: 472.2127
• DSSTox Substance ID: DTXSID70387219
• Mol file: 6068-95-7.mol

Synonyms:1-[3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitrophenyl)ethanone;6068-95-7;CBMicro_010259;ChemDiv1_007645;HMS608L11;DTXSID70387219;SMSF0012962;CB13181;BIM-0010271.P001;EU-0008654;3-(4-bromophenyl)-1-[(4-nitrophenyl)acetyl]-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol

Chemical Property of 1-[3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitrophenyl)ethanone

Chemical Property:

• Vapor Pressure: 1.42E-13mmHg at 25°C
• Boiling Point: 564.4°Cat760mmHg
• Flash Point: 295.1°C
• Density: 1.66g/cm³
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 471.00415
• Heavy Atom Count: 29
• Complexity: 668

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(=NN(C1(C(F)(F)F)O)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Br