3-MeO-PCE C15H23NO structure

Flashcard maker : James Storer

Molecular Formula C15H23NO
Average mass 233.349 Da
Density 1.0±0.1 g/cm3
Boiling Point 345.6±35.0 °C at 760 mmHg
Flash Point 146.0±15.4 °C
Molar Refractivity 71.8±0.4 cm3
Polarizability 28.5±0.5 10-24cm3
Surface Tension 37.9±5.0 dyne/cm
Molar Volume 233.0±5.0 cm3
  • Predicted – ACD/Labs
  • Predicted – ChemAxon

Predicted data is generated using the ACD/Labs Percepta Platform – PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 345.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.0±3.0 kJ/mol
Flash Point: 146.0±15.4 °C
Index of Refraction: 1.528
Molar Refractivity: 71.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.73
ACD/LogD (pH 5.5): 0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.33
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.73
Polar Surface Area: 21 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 37.9±5.0 dyne/cm
Molar Volume: 233.0±5.0 cm3

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