ChemSpider 2D Image | (2E)-3-(1,3-Benzodioxol-5-yl)-1-{4-[bis(4-methoxyphenyl)methyl]-1-piperazinyl}-2-propen-1-one | C29H30N2O5

(2E)-3-(1,3-Benzodioxol-5-yl)-1-{4-[bis(4-methoxyphenyl)methyl]-1-piperazinyl}-2-propen-1-one

  • Molecular FormulaC29H30N2O5
  • Average mass486.559 Da
  • Monoisotopic mass486.215485 Da
  • ChemSpider ID30657501

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(1,3-Benzodioxol-5-yl)-1-{4-[bis(4-methoxyphenyl)methyl]-1-piperazinyl}-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-3-(1,3-Benzodioxol-5-yl)-1-{4-[bis(4-methoxyphenyl)methyl]-1-piperazinyl}-2-propen-1-one [ACD/IUPAC Name]
(2E)-3-(1,3-Benzodioxol-5-yl)-1-{4-[bis(4-méthoxyphényl)méthyl]-1-pipérazinyl}-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 3-(1,3-benzodioxol-5-yl)-1-[4-[bis(4-methoxyphenyl)methyl]-1-piperazinyl]-, (2E)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 666.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 356.6±31.5 °C
Index of Refraction: 1.630
Molar Refractivity: 138.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.61
ACD/LogD (pH 5.5): 3.66
ACD/BCF (pH 5.5): 299.23
ACD/KOC (pH 5.5): 1677.01
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 609.22
ACD/KOC (pH 7.4): 3414.31
Polar Surface Area: 60 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 52.7±3.0 dyne/cm
Molar Volume: 390.0±3.0 cm3

Click to predict properties on the Chemicalize site


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