ChemSpider 2D Image | 5,5'-{1-[4-(1-Ethoxy-1-oxo-3-phenyl-2-propanyl)phenyl]-2,5-dioxo-2,5-dihydro-1H-pyrrole-3,4-diyl}di(2-furoic acid) | C31H23NO10

5,5'-{1-[4-(1-Ethoxy-1-oxo-3-phenyl-2-propanyl)phenyl]-2,5-dioxo-2,5-dihydro-1H-pyrrole-3,4-diyl}di(2-furoic acid)

  • Molecular FormulaC31H23NO10
  • Average mass569.515 Da
  • Monoisotopic mass569.132202 Da
  • ChemSpider ID34544486

More details:

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

2-Furancarboxylic acid, 5,5'-[1-[4-[2-ethoxy-2-oxo-1-(phenylmethyl)ethyl]phenyl]-2,5-dihydro-2,5-dioxo-1H-pyrrole-3,4-diyl]bis- [ACD/Index Name]
5,5'-{1-[4-(1-Ethoxy-1-oxo-3-phenyl-2-propanyl)phenyl]-2,5-dioxo-2,5-dihydro-1H-pyrrol-3,4-diyl}di(2-furoesäure) [German] [ACD/IUPAC Name]
5,5'-{1-[4-(1-Ethoxy-1-oxo-3-phenyl-2-propanyl)phenyl]-2,5-dioxo-2,5-dihydro-1H-pyrrole-3,4-diyl}di(2-furoic acid) [ACD/IUPAC Name]
Acide 5,5'-{1-[4-(1-éthoxy-1-oxo-3-phényl-2-propanyl)phényl]-2,5-dioxo-2,5-dihydro-1H-pyrrole-3,4-diyl}di(2-furoïque) [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: 788.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.4±3.0 kJ/mol
Flash Point: 430.9±32.9 °C
Index of Refraction: 1.651
Molar Refractivity: 143.4±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 165 Å2
Polarizability: 56.8±0.5 10-24cm3
Surface Tension: 67.8±3.0 dyne/cm
Molar Volume: 392.5±3.0 cm3

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