ChemSpider 2D Image | 5-(4-Butoxy-3-ethoxyphenyl)-1-(2,3-dichlorophenyl)-3-hydroxy-4-(2-thienyl)-1,5-dihydro-2H-pyrrol-2-one | C26H25Cl2NO4S

5-(4-Butoxy-3-ethoxyphenyl)-1-(2,3-dichlorophenyl)-3-hydroxy-4-(2-thienyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC26H25Cl2NO4S
  • Average mass518.452 Da
  • Monoisotopic mass517.088135 Da
  • ChemSpider ID59988277

More details:

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

2H-Pyrrol-2-one, 5-(4-butoxy-3-ethoxyphenyl)-1-(2,3-dichlorophenyl)-1,5-dihydro-3-hydroxy-4-(2-thienyl)- [ACD/Index Name]
5-(4-Butoxy-3-ethoxyphenyl)-1-(2,3-dichlorophenyl)-3-hydroxy-4-(2-thienyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-(4-Butoxy-3-éthoxyphényl)-1-(2,3-dichlorophényl)-3-hydroxy-4-(2-thiényl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
5-(4-Butoxy-3-ethoxyphenyl)-1-(2,3-dichlorphenyl)-3-hydroxy-4-(2-thienyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 633.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.4±3.0 kJ/mol
Flash Point: 336.8±31.5 °C
Index of Refraction: 1.634
Molar Refractivity: 136.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.59
ACD/LogD (pH 5.5): 6.05
ACD/BCF (pH 5.5): 23381.46
ACD/KOC (pH 5.5): 46642.19
ACD/LogD (pH 7.4): 6.04
ACD/BCF (pH 7.4): 22729.62
ACD/KOC (pH 7.4): 45341.87
Polar Surface Area: 87 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 55.8±3.0 dyne/cm
Molar Volume: 382.5±3.0 cm3

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