ChemSpider 2D Image | 2-(1,3-Benzodioxol-5-ylmethyl)-7-chloro-1-(3-ethoxy-4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione | C27H20ClNO7

2-(1,3-Benzodioxol-5-ylmethyl)-7-chloro-1-(3-ethoxy-4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

  • Molecular FormulaC27H20ClNO7
  • Average mass505.903 Da
  • Monoisotopic mass505.092834 Da
  • ChemSpider ID3347124

More details:

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

[1]Benzopyrano[2,3-c]pyrrole-3,9-dione, 2-(1,3-benzodioxol-5-ylmethyl)-7-chloro-1-(3-ethoxy-4-hydroxyphenyl)-1,2-dihydro- [ACD/Index Name]
2-(1,3-Benzodioxol-5-ylmethyl)-7-chlor-1-(3-ethoxy-4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrol-3,9-dion [German] [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-ylmethyl)-7-chloro-1-(3-ethoxy-4-hydroxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-ylméthyl)-7-chloro-1-(3-éthoxy-4-hydroxyphényl)-1,2-dihydrochroméno[2,3-c]pyrrole-3,9-dione [French] [ACD/IUPAC Name]
2-(1,3-benzodioxol-5-ylmethyl)-7-chloro-1-(3-ethoxy-4-hydroxyphenyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione
2-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)-7-chloro-1-(3-ethoxy-4-hydroxyphenyl)chromeno[2,3-c]3-pyrroline-3,9-dione
2-[(2H-1,3-benzodioxol-5-yl)methyl]-7-chloro-1-(3-ethoxy-4-hydroxyphenyl)-1H,2H,3H,9H-chromeno[2,3-c]pyrrole-3,9-dione
879911-15-6 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 737.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.4±3.0 kJ/mol
Flash Point: 399.7±32.9 °C
Index of Refraction: 1.726
Molar Refractivity: 128.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 3.41
ACD/BCF (pH 5.5): 228.17
ACD/KOC (pH 5.5): 1696.83
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 227.22
ACD/KOC (pH 7.4): 1689.80
Polar Surface Area: 95 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 79.2±5.0 dyne/cm
Molar Volume: 323.4±5.0 cm3

Click to predict properties on the Chemicalize site


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