ChemSpider 2D Image | 1-Phenyl-1,3-triacontanedione | C36H62O2

1-Phenyl-1,3-triacontanedione

  • Molecular FormulaC36H62O2
  • Average mass526.876 Da
  • Monoisotopic mass526.474976 Da
  • ChemSpider ID57502417

More details:

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

1,3-Triacontanedione, 1-phenyl- [ACD/Index Name]
1-Phenyl-1,3-triacontandion [German] [ACD/IUPAC Name]
1-Phenyl-1,3-triacontanedione [ACD/IUPAC Name]
1-Phényl-1,3-triacontanedione [French] [ACD/IUPAC Name]
1-PHENYLTRIACONTANE-1,3-DIONE
65284-08-4 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 608.8±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.4±3.0 kJ/mol
Flash Point: 220.6±21.0 °C
Index of Refraction: 1.484
Molar Refractivity: 166.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 2
ACD/LogP: 16.33
ACD/LogD (pH 5.5): 14.51
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.50
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 34 Å2
Polarizability: 65.8±0.5 10-24cm3
Surface Tension: 35.0±3.0 dyne/cm
Molar Volume: 580.3±3.0 cm3

Click to predict properties on the Chemicalize site


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