ChemSpider 2D Image | 2-[5-(4-Methoxyphenyl)-3'-methyl-1,1'-diphenyl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-5'-yl]-5-methylphenol | C33H30N4O2

2-[5-(4-Methoxyphenyl)-3'-methyl-1,1'-diphenyl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-5'-yl]-5-methylphenol

  • Molecular FormulaC33H30N4O2
  • Average mass514.617 Da
  • Monoisotopic mass514.236877 Da
  • ChemSpider ID20128202

More details:

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

2-[5-(4-Methoxyphenyl)-3'-methyl-1,1'-diphenyl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-5'-yl]-5-methylphenol [German] [ACD/IUPAC Name]
2-[5-(4-Methoxyphenyl)-3'-methyl-1,1'-diphenyl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-5'-yl]-5-methylphenol [ACD/IUPAC Name]
2-[5-(4-Méthoxyphényl)-3'-méthyl-1,1'-diphényl-4,5-dihydro-1H,1'H-3,4'-bipyrazol-5'-yl]-5-méthylphénol [French] [ACD/IUPAC Name]
Phenol, 2-[4,5-dihydro-5-(4-methoxyphenyl)-3'-methyl-1,1'-diphenyl[3,4'-bi-1H-pyrazol]-5'-yl]-5-methyl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 692.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.1±3.0 kJ/mol
Flash Point: 372.5±34.3 °C
Index of Refraction: 1.652
Molar Refractivity: 155.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 5.87
ACD/BCF (pH 5.5): 16945.45
ACD/KOC (pH 5.5): 37043.68
ACD/LogD (pH 7.4): 5.86
ACD/BCF (pH 7.4): 16653.25
ACD/KOC (pH 7.4): 36404.92
Polar Surface Area: 63 Å2
Polarizability: 61.5±0.5 10-24cm3
Surface Tension: 46.9±7.0 dyne/cm
Molar Volume: 424.1±7.0 cm3

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