ChemSpider 2D Image | 2-[(18-Ethyl-6,7,9,10,18,19-hexahydro-17H-dibenzo[b,k][1,4,7,10,13]pentaoxacyclohexadecin-18-yl)oxy]-N,N-dipentylacetamide | C33H49NO7

2-[(18-Ethyl-6,7,9,10,18,19-hexahydro-17H-dibenzo[b,k][1,4,7,10,13]pentaoxacyclohexadecin-18-yl)oxy]-N,N-dipentylacetamide

  • Molecular FormulaC33H49NO7
  • Average mass571.745 Da
  • Monoisotopic mass571.350891 Da
  • ChemSpider ID8897131

More details:

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

2-[(18-Ethyl-6,7,9,10,18,19-hexahydro-17H-dibenzo[b,k][1,4,7,10,13]pentaoxacyclohexadecin-18-yl)oxy]-N,N-dipentylacetamid [German] [ACD/IUPAC Name]
2-[(18-Ethyl-6,7,9,10,18,19-hexahydro-17H-dibenzo[b,k][1,4,7,10,13]pentaoxacyclohexadecin-18-yl)oxy]-N,N-dipentylacetamide [ACD/IUPAC Name]
2-[(18-Éthyl-6,7,9,10,18,19-hexahydro-17H-dibenzo[b,k][1,4,7,10,13]pentaoxacyclohexadécin-18-yl)oxy]-N,N-dipentylacétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[(18-ethyl-6,7,9,10,18,19-hexahydro-17H-dibenzo[b,k][1,4,7,10,13]pentaoxacyclohexadecin-18-yl)oxy]-N,N-dipentyl- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 663.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.6±3.0 kJ/mol
Flash Point: 355.0±31.5 °C
Index of Refraction: 1.543
Molar Refractivity: 161.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 7.11
ACD/LogD (pH 5.5): 6.93
ACD/BCF (pH 5.5): 108134.47
ACD/KOC (pH 5.5): 139601.42
ACD/LogD (pH 7.4): 6.93
ACD/BCF (pH 7.4): 108134.59
ACD/KOC (pH 7.4): 139601.58
Polar Surface Area: 76 Å2
Polarizability: 63.9±0.5 10-24cm3
Surface Tension: 46.7±5.0 dyne/cm
Molar Volume: 510.9±5.0 cm3

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