ChemSpider 2D Image | 2,9,10-Trimethoxydibenzo[b,d]oxepin-7(6H)-one | C17H16O5

2,9,10-Trimethoxydibenzo[b,d]oxepin-7(6H)-one

  • Molecular FormulaC17H16O5
  • Average mass300.306 Da
  • Monoisotopic mass300.099762 Da
  • ChemSpider ID30657360

More details:

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

2,9,10-Trimethoxydibenzo[b,d]oxepin-7(6H)-on [German] [ACD/IUPAC Name]
2,9,10-Trimethoxydibenzo[b,d]oxepin-7(6H)-one [ACD/IUPAC Name]
2,9,10-Triméthoxydibenzo[b,d]oxépin-7(6H)-one [French] [ACD/IUPAC Name]
Dibenz[b,d]oxepin-7(6H)-one, 2,9,10-trimethoxy- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 487.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 217.7±28.8 °C
Index of Refraction: 1.573
Molar Refractivity: 80.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 2.73
ACD/BCF (pH 5.5): 70.19
ACD/KOC (pH 5.5): 729.72
ACD/LogD (pH 7.4): 2.73
ACD/BCF (pH 7.4): 70.19
ACD/KOC (pH 7.4): 729.72
Polar Surface Area: 54 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 243.4±3.0 cm3

Click to predict properties on the Chemicalize site


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