ChemSpider 2D Image | 1'-(4-Methoxybenzoyl)-5',6',7',7a'-tetrahydro-1'H,2H-dispiro[acenaphthylene-1,3'-pyrrolizine-2',3''-indole]-2,2''(1''H)-dione | C33H26N2O4

1'-(4-Methoxybenzoyl)-5',6',7',7a'-tetrahydro-1'H,2H-dispiro[acenaphthylene-1,3'-pyrrolizine-2',3''-indole]-2,2''(1''H)-dione

  • Molecular FormulaC33H26N2O4
  • Average mass514.570 Da
  • Monoisotopic mass514.189270 Da
  • ChemSpider ID4415553

More details:

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

1'-(4-Methoxybenzoyl)-5',6',7',7a'-tetrahydro-1'H,2H-dispiro[acenaphthylene-1,3'-pyrrolizine-2',3''-indole]-2,2''(1''H)-dion [German] [ACD/IUPAC Name]
1'-(4-Methoxybenzoyl)-5',6',7',7a'-tetrahydro-1'H,2H-dispiro[acenaphthylene-1,3'-pyrrolizine-2',3''-indole]-2,2''(1''H)-dione [ACD/IUPAC Name]
1'-(4-Méthoxybenzoyl)-5',6',7',7a'-tétrahydro-1'H,2H-dispiro[acenaphthylene-1,3'-pyrrolizine-2',3''-indole]-2,2''(1''H)-dione [French] [ACD/IUPAC Name]
Dispiro[acenaphthylene-1(2H),3'-[1H]pyrrolizine-2'(1'H),3''-[3H]indole]-2,2''(1''H)-dione, 5',6',7',7'a-tetrahydro-1'-(4-methoxybenzoyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 767.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.7±3.0 kJ/mol
Flash Point: 417.7±32.9 °C
Index of Refraction: 1.754
Molar Refractivity: 146.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 7.35
ACD/LogD (pH 5.5): 6.54
ACD/BCF (pH 5.5): 54774.91
ACD/KOC (pH 5.5): 85144.80
ACD/LogD (pH 7.4): 6.55
ACD/BCF (pH 7.4): 56239.44
ACD/KOC (pH 7.4): 87421.34
Polar Surface Area: 76 Å2
Polarizability: 57.9±0.5 10-24cm3
Surface Tension: 75.6±5.0 dyne/cm
Molar Volume: 357.0±5.0 cm3

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