ChemSpider 2D Image | 1-[{[1-(3-Chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}(propyl)amino]-3-ethoxy-2-propanol | C26H34ClN3O4

1-[{[1-(3-Chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}(propyl)amino]-3-ethoxy-2-propanol

  • Molecular FormulaC26H34ClN3O4
  • Average mass488.019 Da
  • Monoisotopic mass487.223785 Da
  • ChemSpider ID22692737

More details:

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

1-[{[1-(3-Chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}(propyl)amino]-3-ethoxy-2-propanol [ACD/IUPAC Name]
1-[{[1-(3-Chlorophényl)-5-(4-méthoxyphénoxy)-3-méthyl-1H-pyrazol-4-yl]méthyl}(propyl)amino]-3-éthoxy-2-propanol [French] [ACD/IUPAC Name]
1-[{[1-(3-Chlorphenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl}(propyl)amino]-3-ethoxy-2-propanol [German] [ACD/IUPAC Name]
2-Propanol, 1-[[[1-(3-chlorophenyl)-5-(4-methoxyphenoxy)-3-methyl-1H-pyrazol-4-yl]methyl]propylamino]-3-ethoxy- [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: 608.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.1±3.0 kJ/mol
Flash Point: 321.9±31.5 °C
Index of Refraction: 1.564
Molar Refractivity: 134.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 6.25
ACD/LogD (pH 5.5): 3.81
ACD/BCF (pH 5.5): 220.62
ACD/KOC (pH 5.5): 682.16
ACD/LogD (pH 7.4): 5.06
ACD/BCF (pH 7.4): 3916.66
ACD/KOC (pH 7.4): 12110.28
Polar Surface Area: 69 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 40.4±7.0 dyne/cm
Molar Volume: 414.1±7.0 cm3

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