ChemSpider 2D Image | 4,4'-{3-[(4-Hydroxyphenyl)amino]-1h-Pyrazole-4,5-Diyl}diphenol | C21H17N3O3

4,4'-{3-[(4-Hydroxyphenyl)amino]-1h-Pyrazole-4,5-Diyl}diphenol

  • Molecular FormulaC21H17N3O3
  • Average mass359.378 Da
  • Monoisotopic mass359.126984 Da
  • ChemSpider ID24808310

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4,4'-{3-[(4-Hydroxyphenyl)amino]-1h-Pyrazole-4,5-Diyl}diphenol
4,4'-{5-[(4-Hydroxyphenyl)amino]-1H-pyrazol-3,4-diyl}diphenol [German] [ACD/IUPAC Name]
4,4'-{5-[(4-Hydroxyphenyl)amino]-1H-pyrazole-3,4-diyl}diphenol [ACD/IUPAC Name]
4,4'-{5-[(4-Hydroxyphényl)amino]-1H-pyrazole-3,4-diyl}diphénol [French] [ACD/IUPAC Name]
Phenol, 4,4'-[5-[(4-hydroxyphenyl)amino]-1H-pyrazole-3,4-diyl]bis- [ACD/Index Name]
1CQ
Kinome_3698

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 605.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 320.0±31.5 °C
Index of Refraction: 1.750
Molar Refractivity: 103.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 3.15
ACD/BCF (pH 5.5): 142.65
ACD/KOC (pH 5.5): 1190.81
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 141.99
ACD/KOC (pH 7.4): 1185.32
Polar Surface Area: 101 Å2
Polarizability: 40.8±0.5 10-24cm3
Surface Tension: 75.8±3.0 dyne/cm
Molar Volume: 252.9±3.0 cm3

Click to predict properties on the Chemicalize site


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