ChemSpider 2D Image | 1,3-Phenylenebis{[3-methyl-4-(octyloxy)phenyl]methanone} | C38H50O4

1,3-Phenylenebis{[3-methyl-4-(octyloxy)phenyl]methanone}

  • Molecular FormulaC38H50O4
  • Average mass570.801 Da
  • Monoisotopic mass570.370911 Da
  • ChemSpider ID8897117

More details:

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

1,3-Phenylenbis{[3-methyl-4-(octyloxy)phenyl]methanon} [German] [ACD/IUPAC Name]
1,3-Phenylenebis{[3-methyl-4-(octyloxy)phenyl]methanone} [ACD/IUPAC Name]
1,3-Phénylènebis{[3-méthyl-4-(octyloxy)phényl]méthanone} [French] [ACD/IUPAC Name]
Methanone, 1,1'-(1,3-phenylene)bis[1-[3-methyl-4-(octyloxy)phenyl]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 688.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.9±3.0 kJ/mol
Flash Point: 280.7±31.5 °C
Index of Refraction: 1.536
Molar Refractivity: 173.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 2
ACD/LogP: 12.88
ACD/LogD (pH 5.5): 11.77
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.77
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 53 Å2
Polarizability: 68.9±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 557.3±3.0 cm3

Click to predict properties on the Chemicalize site


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