ChemSpider 2D Image | Bis-(Indole)maleimide Pyridinophane | C34H33N5O2

Bis-(Indole)maleimide Pyridinophane

  • Molecular FormulaC34H33N5O2
  • Average mass543.658 Da
  • Monoisotopic mass543.263428 Da
  • ChemSpider ID20566437

More details:

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

31-(Dimethylamino)-5,15,25,32-tetraazaheptacyclo[28.2.2.15,12.118,25.06,11.013,17.019,24]hexatriaconta-1(32),6,8,10,12(36),13(17),18(35),19,21,23,30,33-dodecaen-14,16-dion [German] [ACD/IUPAC Name]
31-(Dimethylamino)-5,15,25,32-tetraazaheptacyclo[28.2.2.15,12.118,25.06,11.013,17.019,24]hexatriaconta-1(32),6,8,10,12(36),13(17),18(35),19,21,23,30,33-dodecaene-14,16-dione [ACD/IUPAC Name]
31-(Diméthylamino)-5,15,25,32-tétraazaheptacyclo[28.2.2.15,12.118,25.06,11.013,17.019,24]hexatriaconta-1(32),6,8,10,12(36),13(17),18(35),19,21,23,30,33-dodécaène-14,16-dione [French] [ACD/IUPAC Name]
Bis-(Indole)maleimide Pyridinophane

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

Density: 1.3±0.1 g/cm3
Boiling Point: 837.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 121.7±3.0 kJ/mol
Flash Point: 460.4±34.3 °C
Index of Refraction: 1.704
Molar Refractivity: 160.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 2
ACD/LogP: 7.42
ACD/LogD (pH 5.5): 4.80
ACD/BCF (pH 5.5): 1484.87
ACD/KOC (pH 5.5): 3313.25
ACD/LogD (pH 7.4): 5.72
ACD/BCF (pH 7.4): 12273.16
ACD/KOC (pH 7.4): 27385.55
Polar Surface Area: 72 Å2
Polarizability: 63.7±0.5 10-24cm3
Surface Tension: 53.9±7.0 dyne/cm
Molar Volume: 414.0±7.0 cm3

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