ChemSpider 2D Image | Dimethyl 5-[5-(6,7-dimethyl-2,5-dioxo-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridin-4-yl)-2-furyl]isophthalate | C24H21NO8

Dimethyl 5-[5-(6,7-dimethyl-2,5-dioxo-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridin-4-yl)-2-furyl]isophthalate

  • Molecular FormulaC24H21NO8
  • Average mass451.425 Da
  • Monoisotopic mass451.126709 Da
  • ChemSpider ID58173480

More details:

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

1,3-Benzenedicarboxylic acid, 5-[5-(3,4,5,6-tetrahydro-6,7-dimethyl-2,5-dioxo-2H-pyrano[3,2-c]pyridin-4-yl)-2-furanyl]-, dimethyl ester [ACD/Index Name]
5-[5-(6,7-Diméthyl-2,5-dioxo-3,4,5,6-tétrahydro-2H-pyrano[3,2-c]pyridin-4-yl)-2-furyl]isophtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5-[5-(6,7-dimethyl-2,5-dioxo-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridin-4-yl)-2-furyl]isophthalate [ACD/IUPAC Name]
Dimethyl-5-[5-(6,7-dimethyl-2,5-dioxo-3,4,5,6-tetrahydro-2H-pyrano[3,2-c]pyridin-4-yl)-2-furyl]isophthalat [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: 684.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.4±3.0 kJ/mol
Flash Point: 367.8±31.5 °C
Index of Refraction: 1.625
Molar Refractivity: 113.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.88
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 142.19
ACD/KOC (pH 5.5): 1209.56
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 142.19
ACD/KOC (pH 7.4): 1209.56
Polar Surface Area: 112 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 62.0±5.0 dyne/cm
Molar Volume: 320.5±5.0 cm3

Click to predict properties on the Chemicalize site


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