ChemSpider 2D Image | 5-(4-Chloro-3-nitrophenyl)-4-(3,4-dipropoxybenzoyl)-3-hydroxy-1-(2-hydroxyethyl)-1,5-dihydro-2H-pyrrol-2-one | C25H27ClN2O8

5-(4-Chloro-3-nitrophenyl)-4-(3,4-dipropoxybenzoyl)-3-hydroxy-1-(2-hydroxyethyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC25H27ClN2O8
  • Average mass518.943 Da
  • Monoisotopic mass518.145569 Da
  • ChemSpider ID117931717

More details:

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

2H-Pyrrol-2-one, 5-(4-chloro-3-nitrophenyl)-4-(3,4-dipropoxybenzoyl)-1,5-dihydro-3-hydroxy-1-(2-hydroxyethyl)- [ACD/Index Name]
5-(4-Chlor-3-nitrophenyl)-4-(3,4-dipropoxybenzoyl)-3-hydroxy-1-(2-hydroxyethyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
5-(4-Chloro-3-nitrophenyl)-4-(3,4-dipropoxybenzoyl)-3-hydroxy-1-(2-hydroxyethyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-(4-Chloro-3-nitrophényl)-4-(3,4-dipropoxybenzoyl)-3-hydroxy-1-(2-hydroxyéthyl)-1,5-dihydro-2H-pyrrol-2-one [French] [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: 722.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.7±3.0 kJ/mol
Flash Point: 390.5±32.9 °C
Index of Refraction: 1.616
Molar Refractivity: 131.6±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 4.65
ACD/LogD (pH 5.5): 2.21
ACD/BCF (pH 5.5): 15.86
ACD/KOC (pH 5.5): 127.44
ACD/LogD (pH 7.4): 0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.20
Polar Surface Area: 142 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 60.2±3.0 dyne/cm
Molar Volume: 376.6±3.0 cm3

Click to predict properties on the Chemicalize site


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