ChemSpider 2D Image | 5-[(3-Cyanobenzoyl)amino]-1-naphthyl 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate | C29H19N3O5

5-[(3-Cyanobenzoyl)amino]-1-naphthyl 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate

  • Molecular FormulaC29H19N3O5
  • Average mass489.478 Da
  • Monoisotopic mass489.132477 Da
  • ChemSpider ID66068765

More details:

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

2H-Isoindole-2-propanoic acid, 1,3-dihydro-1,3-dioxo-, 5-[(3-cyanobenzoyl)amino]-1-naphthalenyl ester [ACD/Index Name]
3-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate de 5-[(3-cyanobenzoyl)amino]-1-naphtyle [French] [ACD/IUPAC Name]
5-[(3-Cyanbenzoyl)amino]-1-naphthyl-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoat [German] [ACD/IUPAC Name]
5-[(3-Cyanobenzoyl)amino]-1-naphthyl 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate [ACD/IUPAC 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: 667.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.1±3.0 kJ/mol
Flash Point: 357.2±28.7 °C
Index of Refraction: 1.724
Molar Refractivity: 133.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.45
ACD/LogD (pH 5.5): 4.15
ACD/BCF (pH 5.5): 842.35
ACD/KOC (pH 5.5): 4321.85
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 842.34
ACD/KOC (pH 7.4): 4321.79
Polar Surface Area: 117 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 79.3±5.0 dyne/cm
Molar Volume: 337.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement