ChemSpider 2D Image | 1-(1,3-Benzodioxol-5-yl)-2-(ethylamino)-1-pentanone | C14H19NO3

1-(1,3-Benzodioxol-5-yl)-2-(ethylamino)-1-pentanone

  • Molecular FormulaC14H19NO3
  • Average mass249.306 Da
  • Monoisotopic mass249.136490 Da
  • ChemSpider ID26949655

More details:






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

1-(1,3-Benzodioxol-5-yl)-2-(ethylamino)-1-pentanon [German] [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-2-(ethylamino)-1-pentanone [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-2-(éthylamino)-1-pentanone [French] [ACD/IUPAC Name]
1-Pentanone, 1-(1,3-benzodioxol-5-yl)-2-(ethylamino)- [ACD/Index Name]
(??)-1-(1,3-benzodioxol-5-yl)-2-(ethylamino)pentan-1-one
Efylon

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

Density: 1.1±0.1 g/cm3
Boiling Point: 387.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.6±3.0 kJ/mol
Flash Point: 188.1±27.9 °C
Index of Refraction: 1.530
Molar Refractivity: 69.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.40
ACD/LogD (pH 5.5): -0.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.16
ACD/BCF (pH 7.4): 3.13
ACD/KOC (pH 7.4): 51.18
Polar Surface Area: 48 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 223.9±3.0 cm3

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