Found 11 results

Search term: MF = 'C_{39}H_{31}NO_{5}'
ChemSpider 2D Image | 4-[1-(Diphenylmethyl)-3-(4-ethylbenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]phenyl benzoate | C39H31NO5

4-[1-(Diphenylmethyl)-3-(4-ethylbenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]phenyl benzoate

  • Molecular FormulaC39H31NO5
  • Average mass593.667 Da
  • Monoisotopic mass593.220215 Da
  • ChemSpider ID117899207

More details:

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

2H-Pyrrol-2-one, 5-[4-(benzoyloxy)phenyl]-1-(diphenylmethyl)-4-(4-ethylbenzoyl)-1,5-dihydro-3-hydroxy- [ACD/Index Name]
4-[1-(Diphenylmethyl)-3-(4-ethylbenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]phenyl benzoate [ACD/IUPAC Name]
4-[1-(Diphenylmethyl)-3-(4-ethylbenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]phenyl-benzoat [German] [ACD/IUPAC Name]
Benzoate de 4-[1-(diphénylméthyl)-3-(4-éthylbenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]phényle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 790.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.6±3.0 kJ/mol
Flash Point: 432.0±32.9 °C
Index of Refraction: 1.668
Molar Refractivity: 172.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 8.80
ACD/LogD (pH 5.5): 5.90
ACD/BCF (pH 5.5): 10075.68
ACD/KOC (pH 5.5): 12928.51
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 173.81
ACD/KOC (pH 7.4): 223.02
Polar Surface Area: 84 Å2
Polarizability: 68.3±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 462.1±3.0 cm3

Click to predict properties on the Chemicalize site


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