ChemSpider 2D Image | RR110 | C36H32FN7O5

RR110

  • Molecular FormulaC36H32FN7O5
  • Average mass661.682 Da
  • Monoisotopic mass661.244873 Da
  • ChemSpider ID24571150

More details:

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

2,6-Pyridinedicarboxamide, N2,N6-bis[4-(2-aminoethoxy)-2-quinolinyl]-4-[(4-fluorophenyl)methoxy]- [ACD/Index Name]
N,N'-Bis[4-(2-aminoethoxy)-2-chinolinyl]-4-[(4-fluorbenzyl)oxy]-2,6-pyridindicarboxamid [German] [ACD/IUPAC Name]
N,N'-Bis[4-(2-aminoéthoxy)-2-quinoléinyl]-4-[(4-fluorobenzyl)oxy]-2,6-pyridinedicarboxamide [French] [ACD/IUPAC Name]
N,N'-Bis[4-(2-aminoethoxy)-2-quinolinyl]-4-[(4-fluorobenzyl)oxy]-2,6-pyridinedicarboxamide [ACD/IUPAC Name]
RR110
N2,N6-Bis(4-(2-aminoethoxy)quinolin-2-yl)-4-((4-fluorobenzyl)oxy)pyridine-2,6-dicarboxamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 782.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.8±3.0 kJ/mol
Flash Point: 426.8±32.9 °C
Index of Refraction: 1.718
Molar Refractivity: 186.2±0.3 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 3.54
ACD/LogD (pH 5.5): -0.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 21.73
ACD/KOC (pH 7.4): 187.16
Polar Surface Area: 177 Å2
Polarizability: 73.8±0.5 10-24cm3
Surface Tension: 69.4±3.0 dyne/cm
Molar Volume: 472.4±3.0 cm3

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