ChemSpider 2D Image | 4-(1,4,7,10-Tetraazacyclododecan-1-ylmethyl)quinoline | C18H27N5

4-(1,4,7,10-Tetraazacyclododecan-1-ylmethyl)quinoline

  • Molecular FormulaC18H27N5
  • Average mass313.440 Da
  • Monoisotopic mass313.226654 Da
  • ChemSpider ID35035752

More details:

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

4-(1,4,7,10-Tetraazacyclododecan-1-ylmethyl)chinolin [German] [ACD/IUPAC Name]
4-(1,4,7,10-Tétraazacyclododécan-1-ylméthyl)quinoléine [French] [ACD/IUPAC Name]
4-(1,4,7,10-Tetraazacyclododecan-1-ylmethyl)quinoline [ACD/IUPAC Name]
Quinoline, 4-(1,4,7,10-tetraazacyclododec-1-ylmethyl)- [ACD/Index Name]
C4Q

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

Density: 1.1±0.1 g/cm3
Boiling Point: 507.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.7±3.0 kJ/mol
Flash Point: 260.4±28.7 °C
Index of Refraction: 1.555
Molar Refractivity: 95.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.05
ACD/LogD (pH 5.5): -3.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 52 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 39.5±3.0 dyne/cm
Molar Volume: 297.7±3.0 cm3

Click to predict properties on the Chemicalize site


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