ChemSpider 2D Image | 1,1'-(Methylenedi-4,1-phenylene)bis[3-(8-quinolinyl)urea] | C33H26N6O2

1,1'-(Methylenedi-4,1-phenylene)bis[3-(8-quinolinyl)urea]

  • Molecular FormulaC33H26N6O2
  • Average mass538.599 Da
  • Monoisotopic mass538.211731 Da
  • ChemSpider ID30657359

More details:

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

1,1'-(Methylendi-4,1-phenylen)bis[3-(8-chinolinyl)harnstoff] [German] [ACD/IUPAC Name]
1,1'-(Méthylènedi-4,1-phénylène)bis[3-(8-quinoléinyl)urée] [French] [ACD/IUPAC Name]
1,1'-(Methylenedi-4,1-phenylene)bis[3-(8-quinolinyl)urea] [ACD/IUPAC Name]
Urea, N,N''-(methylenedi-4,1-phenylene)bis[N'-8-quinolinyl- [ACD/Index 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: 639.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.4±3.0 kJ/mol
Flash Point: 340.3±31.5 °C
Index of Refraction: 1.805
Molar Refractivity: 165.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 7.50
ACD/LogD (pH 5.5): 6.11
ACD/BCF (pH 5.5): 25903.17
ACD/KOC (pH 5.5): 50117.05
ACD/LogD (pH 7.4): 6.11
ACD/BCF (pH 7.4): 25985.98
ACD/KOC (pH 7.4): 50277.27
Polar Surface Area: 108 Å2
Polarizability: 65.4±0.5 10-24cm3
Surface Tension: 74.9±3.0 dyne/cm
Molar Volume: 384.4±3.0 cm3

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