ChemSpider 2D Image | N,N-Dimethyl-1-{5-[1-(2,6,15-trimethyl-5,14-dioxo-12-propyl-4,13,19,20-tetraoxatricyclo[14.2.1.1~7,10~]icos-3-yl)ethyl]tetrahydro-2-furanyl}-2-pentanaminium | C35H62NO7

N,N-Dimethyl-1-{5-[1-(2,6,15-trimethyl-5,14-dioxo-12-propyl-4,13,19,20-tetraoxatricyclo[14.2.1.17,10]icos-3-yl)ethyl]tetrahydro-2-furanyl}-2-pentanaminium

  • Molecular FormulaC35H62NO7
  • Average mass608.869 Da
  • Monoisotopic mass608.452087 Da
  • ChemSpider ID21432791

  • Charge - Charge

More details:

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

4,13,19,20-Tetraoxatricyclo[14.2.1.17,10]eicosane-3,12-dione, 5-[1-[5-[2-(dimethylamino)pentyl]tetrahydro-2-furanyl]ethyl]-2,6,11-trimethyl-14-propyl-, conjugate acid [ACD/Index Name]
N,N-Dimethyl-1-{5-[1-(2,6,15-trimethyl-5,14-dioxo-12-propyl-4,13,19,20-tetraoxatricyclo[14.2.1.17,10]icos-3-yl)ethyl]tetrahydro-2-furanyl}-2-pentanaminium [ACD/IUPAC Name]
N,N-Dimethyl-1-{5-[1-(2,6,15-trimethyl-5,14-dioxo-12-propyl-4,13,19,20-tetraoxatricyclo[14.2.1.17,10]icos-3-yl)ethyl]tetrahydro-2-furanyl}-2-pentanaminium [German] [ACD/IUPAC Name]
N,N-Diméthyl-1-{5-[1-(2,6,15-triméthyl-5,14-dioxo-12-propyl-4,13,19,20-tétraoxatricyclo[14.2.1.17,10]icos-3-yl)éthyl]tétrahydro-2-furanyl}-2-pentanaminium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 713.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.3±3.0 kJ/mol
Flash Point: 385.2±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.46
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 3.84
ACD/KOC (pH 5.5): 12.38
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 36.65
ACD/KOC (pH 7.4): 118.33
Polar Surface Area: 85 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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