ChemSpider 2D Image | Dibutyl 3-methyl-9,10-dioxo-6-propoxy-9,10-dihydroanthracene-1,8-diyl biscarbonate | C28H32O9

Dibutyl 3-methyl-9,10-dioxo-6-propoxy-9,10-dihydroanthracene-1,8-diyl biscarbonate

  • Molecular FormulaC28H32O9
  • Average mass512.548 Da
  • Monoisotopic mass512.204651 Da
  • ChemSpider ID23137068

More details:

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

Biscarbonate de dibutyle et de 3-méthyl-9,10-dioxo-6-propoxy-9,10-dihydroanthracène-1,8-diyle [French] [ACD/IUPAC Name]
Carbonic acid, dibutyl 9,10-dihydro-3-methyl-9,10-dioxo-6-propoxy-1,8-anthracenediyl ester [ACD/Index Name]
Dibutyl 3-methyl-9,10-dioxo-6-propoxy-9,10-dihydroanthracene-1,8-diyl biscarbonate [ACD/IUPAC Name]
Dibutyl-3-methyl-9,10-dioxo-6-propoxy-9,10-dihydroanthracen-1,8-diylbiscarbonat [German] [ACD/IUPAC Name]
Carbonic acid 8-butoxycarbonyloxy-3-methyl-9,10-dioxo-6-propoxy-9,10-dihydro-anthracen-1-yl ester butyl ester

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

Density: 1.2±0.1 g/cm3
Boiling Point: 659.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 278.4±31.5 °C
Index of Refraction: 1.549
Molar Refractivity: 133.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 6.69
ACD/LogD (pH 5.5): 5.76
ACD/BCF (pH 5.5): 13949.14
ACD/KOC (pH 5.5): 32229.61
ACD/LogD (pH 7.4): 5.76
ACD/BCF (pH 7.4): 13949.14
ACD/KOC (pH 7.4): 32229.61
Polar Surface Area: 114 Å2
Polarizability: 52.9±0.5 10-24cm3
Surface Tension: 47.5±3.0 dyne/cm
Molar Volume: 419.4±3.0 cm3

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