ChemSpider 2D Image | 3-Bromo-4-(4-methoxyphenyl)-1,9-diphenyl-7-oxa-1,2,8-triazaspiro[4.4]nona-2,8-dien-6-one | C24H18BrN3O3

3-Bromo-4-(4-methoxyphenyl)-1,9-diphenyl-7-oxa-1,2,8-triazaspiro[4.4]nona-2,8-dien-6-one

  • Molecular FormulaC24H18BrN3O3
  • Average mass476.322 Da
  • Monoisotopic mass475.053131 Da
  • ChemSpider ID21134025

More details:

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

3-Brom-4-(4-methoxyphenyl)-1,9-diphenyl-7-oxa-1,2,8-triazaspiro[4.4]nona-2,8-dien-6-on [German] [ACD/IUPAC Name]
3-Bromo-4-(4-methoxyphenyl)-1,9-diphenyl-7-oxa-1,2,8-triazaspiro[4.4]nona-2,8-dien-6-one [ACD/IUPAC Name]
3-Bromo-4-(4-méthoxyphényl)-1,9-diphényl-7-oxa-1,2,8-triazaspiro[4.4]nona-2,8-dién-6-one [French] [ACD/IUPAC Name]
7-Oxa-1,2,8-triazaspiro[4.4]nona-2,8-dien-6-one, 3-bromo-4-(4-methoxyphenyl)-1,9-diphenyl- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 599.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.2±3.0 kJ/mol
Flash Point: 316.0±32.9 °C
Index of Refraction: 1.678
Molar Refractivity: 122.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.43
ACD/LogD (pH 5.5): 4.60
ACD/BCF (pH 5.5): 1843.45
ACD/KOC (pH 5.5): 7570.70
ACD/LogD (pH 7.4): 4.60
ACD/BCF (pH 7.4): 1843.45
ACD/KOC (pH 7.4): 7570.70
Polar Surface Area: 63 Å2
Polarizability: 48.4±0.5 10-24cm3
Surface Tension: 53.6±7.0 dyne/cm
Molar Volume: 323.6±7.0 cm3

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