ChemSpider 2D Image | Bis[2-(4-butoxyphenoxy)ethyl] malonate | C27H36O8

Bis[2-(4-butoxyphenoxy)ethyl] malonate

  • Molecular FormulaC27H36O8
  • Average mass488.570 Da
  • Monoisotopic mass488.241028 Da
  • ChemSpider ID24764463

More details:

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

Bis[2-(4-butoxyphenoxy)ethyl] malonate [ACD/IUPAC Name]
Bis[2-(4-butoxyphenoxy)ethyl]-malonat [German] [ACD/IUPAC Name]
Malonate de bis[2-(4-butoxyphénoxy)éthyle] [French] [ACD/IUPAC Name]
Propanedioic acid, bis[2-(4-butoxyphenoxy)ethyl] ester [ACD/Index Name]
di2-(4-butoxyphenoxy)ethyl propane-1,3-dioate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 582.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.1±3.0 kJ/mol
Flash Point: 245.6±27.4 °C
Index of Refraction: 1.518
Molar Refractivity: 131.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 5.63
ACD/LogD (pH 5.5): 5.06
ACD/BCF (pH 5.5): 4100.67
ACD/KOC (pH 5.5): 13417.61
ACD/LogD (pH 7.4): 5.06
ACD/BCF (pH 7.4): 4099.91
ACD/KOC (pH 7.4): 13415.10
Polar Surface Area: 90 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 434.9±3.0 cm3

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