ChemSpider 2D Image | 2-[3-(3,4-Dichlorophenyl)-4-hydroxy-1-(1H-indazol-6-yl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoic acid | C24H15Cl2N3O4

2-[3-(3,4-Dichlorophenyl)-4-hydroxy-1-(1H-indazol-6-yl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoic acid

  • Molecular FormulaC24H15Cl2N3O4
  • Average mass480.300 Da
  • Monoisotopic mass479.043976 Da
  • ChemSpider ID59764848

More details:

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

2-[3-(3,4-Dichlorophenyl)-4-hydroxy-1-(1H-indazol-6-yl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoic acid [ACD/IUPAC Name]
2-[3-(3,4-Dichlorphenyl)-4-hydroxy-1-(1H-indazol-6-yl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoesäure [German] [ACD/IUPAC Name]
Acide 2-[3-(3,4-dichlorophényl)-4-hydroxy-1-(1H-indazol-6-yl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-[3-(3,4-dichlorophenyl)-2,5-dihydro-4-hydroxy-1-(1H-indazol-6-yl)-5-oxo-1H-pyrrol-2-yl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 710.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.1±3.0 kJ/mol
Flash Point: 383.8±32.9 °C
Index of Refraction: 1.772
Molar Refractivity: 123.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 38.16
ACD/KOC (pH 5.5): 148.06
ACD/LogD (pH 7.4): 1.66
ACD/BCF (pH 7.4): 1.98
ACD/KOC (pH 7.4): 7.68
Polar Surface Area: 107 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 86.1±3.0 dyne/cm
Molar Volume: 297.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement