ChemSpider 2D Image | 7,10,13,16,29,32,35,38-Octaoxa-19,26-diazatetracyclo[38.2.2.2~2,5~.2~21,24~]octatetraconta-1(42),2,4,21,23,40,43,45,47-nonaene-20,25-dione | C38H50N2O10

7,10,13,16,29,32,35,38-Octaoxa-19,26-diazatetracyclo[38.2.2.22,5.221,24]octatetraconta-1(42),2,4,21,23,40,43,45,47-nonaene-20,25-dione

  • Molecular FormulaC38H50N2O10
  • Average mass694.811 Da
  • Monoisotopic mass694.346558 Da
  • ChemSpider ID9989926

More details:

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

7,10,13,16,29,32,35,38-Octaoxa-19,26-diazatetracyclo[38.2.2.22,5.221,24]octatetraconta-1(42),2,4,21,23,40,43,45,47-nonaen-20,25-dion [German] [ACD/IUPAC Name]
7,10,13,16,29,32,35,38-Octaoxa-19,26-diazatetracyclo[38.2.2.22,5.221,24]octatetraconta-1(42),2,4,21,23,40,43,45,47-nonaene-20,25-dione [ACD/IUPAC Name]
7,10,13,16,29,32,35,38-Octaoxa-19,26-diazatétracyclo[38.2.2.22,5.221,24]octatétraconta-1(42),2,4,21,23,40,43,45,47-nonaène-20,25-dione [French] [ACD/IUPAC Name]
7,10,13,16,29,32,35,38-Octaoxa-19,26-diazatetracyclo[38.2.2.22,5.221,24]octatetraconta-2,4,21,23,40,42,43,45,47-nonaene-20,25-dione [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 959.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 139.9±3.0 kJ/mol
Flash Point: 534.3±34.3 °C
Index of Refraction: 1.491
Molar Refractivity: 185.8±0.3 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 2.19
ACD/BCF (pH 5.5): 27.32
ACD/KOC (pH 5.5): 371.37
ACD/LogD (pH 7.4): 2.19
ACD/BCF (pH 7.4): 27.32
ACD/KOC (pH 7.4): 371.37
Polar Surface Area: 132 Å2
Polarizability: 73.7±0.5 10-24cm3
Surface Tension: 33.9±3.0 dyne/cm
Molar Volume: 641.4±3.0 cm3

Click to predict properties on the Chemicalize site


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