ChemSpider 2D Image | 4,4'-(1,4,7,10-Tetraazacyclododecane-1,7-diyl)bis(7-chloroquinoline) | C26H28Cl2N6

4,4'-(1,4,7,10-Tetraazacyclododecane-1,7-diyl)bis(7-chloroquinoline)

  • Molecular FormulaC26H28Cl2N6
  • Average mass495.447 Da
  • Monoisotopic mass494.175262 Da
  • ChemSpider ID26390544

More details:

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

4,4'-(1,4,7,10-Tetraazacyclododecan-1,7-diyl)bis(7-chlorchinolin) [German] [ACD/IUPAC Name]
4,4'-(1,4,7,10-Tétraazacyclododécane-1,7-diyl)bis(7-chloroquinoléine) [French] [ACD/IUPAC Name]
4,4'-(1,4,7,10-Tetraazacyclododecane-1,7-diyl)bis(7-chloroquinoline) [ACD/IUPAC Name]
Quinoline, 4,4'-(1,4,7,10-tetraazacyclododecane-1,7-diyl)bis[7-chloro- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 720.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.2±3.0 kJ/mol
Flash Point: 389.3±31.5 °C
Index of Refraction: 1.636
Molar Refractivity: 141.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.46
ACD/LogD (pH 5.5): -1.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.55
Polar Surface Area: 56 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 394.0±3.0 cm3

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