ChemSpider 2D Image | Ethyl 5-({2-[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxo-1-propen-1-yl]-4-chlorophenoxy}methyl)-2-furoate | C24H19ClO7

Ethyl 5-({2-[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxo-1-propen-1-yl]-4-chlorophenoxy}methyl)-2-furoate

  • Molecular FormulaC24H19ClO7
  • Average mass454.857 Da
  • Monoisotopic mass454.081940 Da
  • ChemSpider ID126672510

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Furancarboxylic acid, 5-[[2-[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxo-1-propen-1-yl]-4-chlorophenoxy]methyl]-, ethyl ester [ACD/Index Name]
5-({2-[(1E)-3-(1,3-Benzodioxol-5-yl)-3-oxo-1-propén-1-yl]-4-chlorophénoxy}méthyl)-2-furoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-({2-[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxo-1-propen-1-yl]-4-chlorophenoxy}methyl)-2-furoate [ACD/IUPAC Name]
Ethyl-5-({2-[(1E)-3-(1,3-benzodioxol-5-yl)-3-oxo-1-propen-1-yl]-4-chlorphenoxy}methyl)-2-furoat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 640.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.5±3.0 kJ/mol
Flash Point: 341.0±31.5 °C
Index of Refraction: 1.623
Molar Refractivity: 118.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.08
ACD/LogD (pH 5.5): 4.61
ACD/BCF (pH 5.5): 1878.63
ACD/KOC (pH 5.5): 7673.84
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1878.63
ACD/KOC (pH 7.4): 7673.84
Polar Surface Area: 84 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 334.9±3.0 cm3

Click to predict properties on the Chemicalize site


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