ChemSpider 2D Image | Bis[4-(butoxycarbonyl)phenyl] azelaate | C31H40O8

Bis[4-(butoxycarbonyl)phenyl] azelaate

  • Molecular FormulaC31H40O8
  • Average mass540.644 Da
  • Monoisotopic mass540.272339 Da
  • ChemSpider ID4114932

More details:

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

Azélaïqueate de bis[4-(butoxycarbonyl)phényle] [French] [ACD/IUPAC Name]
Bis[4-(butoxycarbonyl)phenyl] azelaate [ACD/IUPAC Name]
Bis[4-(butoxycarbonyl)phenyl]azelaat [German] [ACD/IUPAC Name]
Nonanedioic acid, bis[4-(butoxycarbonyl)phenyl] ester [ACD/Index Name]
BIS[4-(BUTOXYCARBONYL)PHENYL] NONANEDIOATE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 644.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.1±3.0 kJ/mol
Flash Point: 268.0±30.2 °C
Index of Refraction: 1.523
Molar Refractivity: 147.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 2
ACD/LogP: 8.66
ACD/LogD (pH 5.5): 7.59
ACD/BCF (pH 5.5): 346556.41
ACD/KOC (pH 5.5): 321324.41
ACD/LogD (pH 7.4): 7.59
ACD/BCF (pH 7.4): 346556.41
ACD/KOC (pH 7.4): 321324.41
Polar Surface Area: 105 Å2
Polarizability: 58.5±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 482.9±3.0 cm3

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