ChemSpider 2D Image | 3,3'-[1,3-Propanediylbis(oxy)]bis[6-chloro-2-(2-furyl)-4H-chromen-4-one] | C29H18Cl2O8

3,3'-[1,3-Propanediylbis(oxy)]bis[6-chloro-2-(2-furyl)-4H-chromen-4-one]

  • Molecular FormulaC29H18Cl2O8
  • Average mass565.354 Da
  • Monoisotopic mass564.037903 Da
  • ChemSpider ID21134599

More details:

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

3,3'-[1,3-Propandiylbis(oxy)]bis[6-chlor-2-(2-furyl)-4H-chromen-4-on] [German] [ACD/IUPAC Name]
3,3'-[1,3-Propanediylbis(oxy)]bis[6-chloro-2-(2-furyl)-4H-chromen-4-one] [ACD/IUPAC Name]
3,3'-[1,3-Propanediylbis(oxy)]bis[6-chloro-2-(2-furyl)-4H-chromén-4-one] [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3,3'-[1,3-propanediylbis(oxy)]bis[6-chloro-2-(2-furanyl)- [ACD/Index 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: 742.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.3±3.0 kJ/mol
Flash Point: 402.8±32.9 °C
Index of Refraction: 1.684
Molar Refractivity: 139.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.86
ACD/LogD (pH 5.5): 5.07
ACD/BCF (pH 5.5): 4202.18
ACD/KOC (pH 5.5): 13654.53
ACD/LogD (pH 7.4): 5.07
ACD/BCF (pH 7.4): 4202.18
ACD/KOC (pH 7.4): 13654.53
Polar Surface Area: 97 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 69.9±5.0 dyne/cm
Molar Volume: 366.6±5.0 cm3

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