ChemSpider 2D Image | (2Z)-3-(1,3-Benzodioxol-5-yl)-1-(4-methylphenyl)-2-propen-1-one | C17H14O3

(2Z)-3-(1,3-Benzodioxol-5-yl)-1-(4-methylphenyl)-2-propen-1-one

  • Molecular FormulaC17H14O3
  • Average mass266.291 Da
  • Monoisotopic mass266.094299 Da
  • ChemSpider ID21473636

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3-(1,3-Benzodioxol-5-yl)-1-(4-methylphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2Z)-3-(1,3-Benzodioxol-5-yl)-1-(4-methylphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2Z)-3-(1,3-Benzodioxol-5-yl)-1-(4-méthylphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 3-(1,3-benzodioxol-5-yl)-1-(4-methylphenyl)-, (2Z)- [ACD/Index Name]
3-(1,3-benzodioxol-5-yl)-1-(4-methylphenyl)prop-2-en-1-one
37620-38-5 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 434.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 208.1±15.1 °C
Index of Refraction: 1.638
Molar Refractivity: 78.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 320.73
ACD/KOC (pH 5.5): 2165.22
ACD/LogD (pH 7.4): 3.60
ACD/BCF (pH 7.4): 320.73
ACD/KOC (pH 7.4): 2165.22
Polar Surface Area: 36 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 52.2±3.0 dyne/cm
Molar Volume: 217.3±3.0 cm3

Click to predict properties on the Chemicalize site


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