ChemSpider 2D Image | [5-(4-Methoxyphenyl)-2-furyl][7-(2-methylphenyl)-9-(tetrahydro-3-furanyloxy)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone | C32H31NO6

[5-(4-Methoxyphenyl)-2-furyl][7-(2-methylphenyl)-9-(tetrahydro-3-furanyloxy)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone

  • Molecular FormulaC32H31NO6
  • Average mass525.592 Da
  • Monoisotopic mass525.215149 Da
  • ChemSpider ID22160078

More details:

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

[5-(4-Methoxyphenyl)-2-furyl][7-(2-methylphenyl)-9-(tetrahydro-3-furanyloxy)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanon [German] [ACD/IUPAC Name]
[5-(4-Methoxyphenyl)-2-furyl][7-(2-methylphenyl)-9-(tetrahydro-3-furanyloxy)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone [ACD/IUPAC Name]
[5-(4-Méthoxyphényl)-2-furyl][7-(2-méthylphényl)-9-(tétrahydro-3-furanyloxy)-2,3-dihydro-1,4-benzoxazépin-4(5H)-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, [2,3-dihydro-7-(2-methylphenyl)-9-[(tetrahydro-3-furanyl)oxy]-1,4-benzoxazepin-4(5H)-yl][5-(4-methoxyphenyl)-2-furanyl]- [ACD/Index Name]
4-[5-(4-methoxyphenyl)-2-furoyl]-7-(2-methylphenyl)-9-(tetrahydro-3-furanyloxy)-2,3,4,5-tetrahydro-1,4-benzoxazepine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 714.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.5±3.0 kJ/mol
Flash Point: 386.1±32.9 °C
Index of Refraction: 1.602
Molar Refractivity: 146.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.79
ACD/LogD (pH 5.5): 4.70
ACD/BCF (pH 5.5): 2200.60
ACD/KOC (pH 5.5): 8593.83
ACD/LogD (pH 7.4): 4.70
ACD/BCF (pH 7.4): 2200.60
ACD/KOC (pH 7.4): 8593.83
Polar Surface Area: 70 Å2
Polarizability: 58.0±0.5 10-24cm3
Surface Tension: 47.9±3.0 dyne/cm
Molar Volume: 426.6±3.0 cm3

Click to predict properties on the Chemicalize site


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