ChemSpider 2D Image | 1,1'-[(Cyclopentylidenemethylene)bis(4,1-phenyleneoxy-2,1-ethanediyl)]diazepane | C34H48N2O2

1,1'-[(Cyclopentylidenemethylene)bis(4,1-phenyleneoxy-2,1-ethanediyl)]diazepane

  • Molecular FormulaC34H48N2O2
  • Average mass516.757 Da
  • Monoisotopic mass516.371582 Da
  • ChemSpider ID31126008

More details:

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

1,1'-[(Cyclopentylidenemethylene)bis(4,1-phenyleneoxy-2,1-ethanediyl)]diazepane [ACD/IUPAC Name]
1,1'-[(Cyclopentylidèneméthylène)bis(4,1-phénylèneoxy-2,1-éthanediyl)]diazépane [French] [ACD/IUPAC Name]
1,1'-[(Cyclopentylidenmethylen)bis(4,1-phenylenoxy-2,1-ethandiyl)]diazepan [German] [ACD/IUPAC Name]
1H-Azepine, 1,1'-[(cyclopentylidenemethylene)bis(4,1-phenyleneoxy-2,1-ethanediyl)]bis[hexahydro- [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: 662.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.4±3.0 kJ/mol
Flash Point: 167.5±28.7 °C
Index of Refraction: 1.562
Molar Refractivity: 157.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 9.50
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 35.48
ACD/KOC (pH 5.5): 30.70
ACD/LogD (pH 7.4): 4.82
ACD/BCF (pH 7.4): 548.08
ACD/KOC (pH 7.4): 474.18
Polar Surface Area: 25 Å2
Polarizability: 62.6±0.5 10-24cm3
Surface Tension: 42.3±3.0 dyne/cm
Molar Volume: 486.5±3.0 cm3

Click to predict properties on the Chemicalize site


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