ChemSpider 2D Image | (7-Acetamido-2-oxo-2H-chromen-4-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoate | C24H21NO8

(7-Acetamido-2-oxo-2H-chromen-4-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoate

  • Molecular FormulaC24H21NO8
  • Average mass451.425 Da
  • Monoisotopic mass451.126709 Da
  • ChemSpider ID22764163

More details:

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

(7-Acetamido-2-oxo-2H-chromen-4-yl)methyl 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoate [ACD/IUPAC Name]
(7-Acetamido-2-oxo-2H-chromen-4-yl)methyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoat [German] [ACD/IUPAC Name]
1,4-Benzodioxin-6-butanoic acid, 2,3-dihydro-γ-oxo-, [7-(acetylamino)-2-oxo-2H-1-benzopyran-4-yl]methyl ester [ACD/Index Name]
4-(2,3-Dihydro-1,4-benzodioxin-6-yl)-4-oxobutanoate de (7-acétamido-2-oxo-2H-chromén-4-yl)méthyle [French] [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: 746.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.8±3.0 kJ/mol
Flash Point: 405.0±32.9 °C
Index of Refraction: 1.619
Molar Refractivity: 114.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 69.21
ACD/KOC (pH 5.5): 722.45
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 69.21
ACD/KOC (pH 7.4): 722.45
Polar Surface Area: 117 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 59.0±3.0 dyne/cm
Molar Volume: 327.1±3.0 cm3

Click to predict properties on the Chemicalize site


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