ChemSpider 2D Image | 1-[2-(4-Chlorophenyl)ethyl]-3-(1-naphthyl)-4-{[1-(5,6,7,8-tetrahydro-2-naphthalenyl)ethyl]amino}-1H-pyrrole-2,5-dione | C34H31ClN2O2

1-[2-(4-Chlorophenyl)ethyl]-3-(1-naphthyl)-4-{[1-(5,6,7,8-tetrahydro-2-naphthalenyl)ethyl]amino}-1H-pyrrole-2,5-dione

  • Molecular FormulaC34H31ClN2O2
  • Average mass535.075 Da
  • Monoisotopic mass534.207397 Da
  • ChemSpider ID119237500

More details:

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

1-[2-(4-Chlorophenyl)ethyl]-3-(1-naphthyl)-4-{[1-(5,6,7,8-tetrahydro-2-naphthalenyl)ethyl]amino}-1H-pyrrole-2,5-dione [ACD/IUPAC Name]
1-[2-(4-Chlorophényl)éthyl]-3-(1-naphtyl)-4-{[1-(5,6,7,8-tétrahydro-2-naphtalényl)éthyl]amino}-1H-pyrrole-2,5-dione [French] [ACD/IUPAC Name]
1-[2-(4-Chlorphenyl)ethyl]-3-(1-naphthyl)-4-{[1-(5,6,7,8-tetrahydro-2-naphthalinyl)ethyl]amino}-1H-pyrrol-2,5-dion [German] [ACD/IUPAC Name]
1H-Pyrrole-2,5-dione, 1-[2-(4-chlorophenyl)ethyl]-3-(1-naphthalenyl)-4-[[1-(5,6,7,8-tetrahydro-2-naphthalenyl)ethyl]amino]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 726.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.1±3.0 kJ/mol
Flash Point: 393.3±32.9 °C
Index of Refraction: 1.691
Molar Refractivity: 157.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 9.18
ACD/LogD (pH 5.5): 7.82
ACD/BCF (pH 5.5): 520332.47
ACD/KOC (pH 5.5): 429817.97
ACD/LogD (pH 7.4): 7.82
ACD/BCF (pH 7.4): 520335.34
ACD/KOC (pH 7.4): 429820.34
Polar Surface Area: 49 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 62.4±5.0 dyne/cm
Molar Volume: 410.8±5.0 cm3

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