ChemSpider 2D Image | (~2~H_9_)-1-Pyrenyl acetate | C18H3D9O2

(2H9)-1-Pyrenyl acetate

  • Molecular FormulaC18H3D9O2
  • Average mass269.342 Da
  • Monoisotopic mass269.140228 Da
  • ChemSpider ID76837230

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H9)-1-Pyrenyl acetate [ACD/IUPAC Name]
(2H9)-1-Pyrenyl-acetat [German] [ACD/IUPAC Name]
1-Pyren-d9-ol, acetate [ACD/Index Name]
Acétate de (2H9)-1-pyrényle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 442.6±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.0±3.0 kJ/mol
Flash Point: 141.2±9.1 °C
Index of Refraction: 1.781
Molar Refractivity: 83.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 4.71
ACD/BCF (pH 5.5): 2232.84
ACD/KOC (pH 5.5): 8683.78
ACD/LogD (pH 7.4): 4.71
ACD/BCF (pH 7.4): 2232.84
ACD/KOC (pH 7.4): 8683.78
Polar Surface Area: 26 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 58.2±3.0 dyne/cm
Molar Volume: 199.6±3.0 cm3

Click to predict properties on the Chemicalize site


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