ChemSpider 2D Image | 4-(4-Chloro-2,5-dimethoxybenzoyl)-3-hydroxy-5-(4-hydroxy-3-nitrophenyl)-1-propyl-1,5-dihydro-2H-pyrrol-2-one | C22H21ClN2O8

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

  • Molecular FormulaC22H21ClN2O8
  • Average mass476.864 Da
  • Monoisotopic mass476.098633 Da
  • ChemSpider ID34903503

More details:

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

2H-Pyrrol-2-one, 4-(4-chloro-2,5-dimethoxybenzoyl)-1,5-dihydro-3-hydroxy-5-(4-hydroxy-3-nitrophenyl)-1-propyl- [ACD/Index Name]
4-(4-Chlor-2,5-dimethoxybenzoyl)-3-hydroxy-5-(4-hydroxy-3-nitrophenyl)-1-propyl-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
4-(4-Chloro-2,5-dimethoxybenzoyl)-3-hydroxy-5-(4-hydroxy-3-nitrophenyl)-1-propyl-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
4-(4-Chloro-2,5-diméthoxybenzoyl)-3-hydroxy-5-(4-hydroxy-3-nitrophényl)-1-propyl-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: 1.5±0.1 g/cm3
Boiling Point: 694.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.8±3.0 kJ/mol
Flash Point: 373.7±31.5 °C
Index of Refraction: 1.639
Molar Refractivity: 118.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.15
ACD/LogD (pH 5.5): 2.18
ACD/BCF (pH 5.5): 14.64
ACD/KOC (pH 5.5): 117.30
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 142 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 63.8±3.0 dyne/cm
Molar Volume: 328.0±3.0 cm3

Click to predict properties on the Chemicalize site


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