ChemSpider 2D Image | 9-[3-Allyl-4-(allyloxy)-5-methoxyphenyl]-10-benzyl-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydro-1,8(2H,5H)-acridinedione | C37H43NO4

9-[3-Allyl-4-(allyloxy)-5-methoxyphenyl]-10-benzyl-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydro-1,8(2H,5H)-acridinedione

  • Molecular FormulaC37H43NO4
  • Average mass565.742 Da
  • Monoisotopic mass565.319214 Da
  • ChemSpider ID79591649

More details:

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

1,8(2H,5H)-Acridinedione, 3,4,6,7,9,10-hexahydro-9-[3-methoxy-5-(2-propen-1-yl)-4-(2-propen-1-yloxy)phenyl]-3,3,6,6-tetramethyl-10-(phenylmethyl)- [ACD/Index Name]
9-[3-Allyl-4-(allyloxy)-5-methoxyphenyl]-10-benzyl-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydro-1,8(2H,5H)-acridindion [German] [ACD/IUPAC Name]
9-[3-Allyl-4-(allyloxy)-5-methoxyphenyl]-10-benzyl-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydro-1,8(2H,5H)-acridinedione [ACD/IUPAC Name]
9-[3-Allyl-4-(allyloxy)-5-méthoxyphényl]-10-benzyl-3,3,6,6-tétraméthyl-3,4,6,7,9,10-hexahydro-1,8(2H,5H)-acridinedione [French] [ACD/IUPAC 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: 682.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.1±3.0 kJ/mol
Flash Point: 366.5±31.5 °C
Index of Refraction: 1.601
Molar Refractivity: 167.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.37
ACD/LogD (pH 5.5): 7.33
ACD/BCF (pH 5.5): 220025.03
ACD/KOC (pH 5.5): 232115.45
ACD/LogD (pH 7.4): 7.33
ACD/BCF (pH 7.4): 220047.25
ACD/KOC (pH 7.4): 232138.91
Polar Surface Area: 56 Å2
Polarizability: 66.3±0.5 10-24cm3
Surface Tension: 49.2±5.0 dyne/cm
Molar Volume: 487.7±5.0 cm3

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