ChemSpider 2D Image | 4-(3-{[2-(Dimethylamino)-2-(4-ethylphenyl)ethyl]amino}-3-oxo-2-[(2,3,6-trichlorobenzoyl)amino]propyl)phenyl acetate | C30H32Cl3N3O4

4-(3-{[2-(Dimethylamino)-2-(4-ethylphenyl)ethyl]amino}-3-oxo-2-[(2,3,6-trichlorobenzoyl)amino]propyl)phenyl acetate

  • Molecular FormulaC30H32Cl3N3O4
  • Average mass604.952 Da
  • Monoisotopic mass603.145813 Da
  • ChemSpider ID121118188

More details:

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

4-(3-{[2-(Dimethylamino)-2-(4-ethylphenyl)ethyl]amino}-3-oxo-2-[(2,3,6-trichlorbenzoyl)amino]propyl)phenyl-acetat [German] [ACD/IUPAC Name]
4-(3-{[2-(Dimethylamino)-2-(4-ethylphenyl)ethyl]amino}-3-oxo-2-[(2,3,6-trichlorobenzoyl)amino]propyl)phenyl acetate [ACD/IUPAC Name]
Acétate de 4-(3-{[2-(diméthylamino)-2-(4-éthylphényl)éthyl]amino}-3-oxo-2-[(2,3,6-trichlorobenzoyl)amino]propyl)phényle [French] [ACD/IUPAC Name]
Benzenepropanamide, 4-(acetyloxy)-N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-α-[(2,3,6-trichlorobenzoyl)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: 725.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.0±3.0 kJ/mol
Flash Point: 392.8±32.9 °C
Index of Refraction: 1.593
Molar Refractivity: 159.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.55
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 71.35
ACD/KOC (pH 5.5): 191.32
ACD/LogD (pH 7.4): 5.04
ACD/BCF (pH 7.4): 3190.37
ACD/KOC (pH 7.4): 8555.11
Polar Surface Area: 88 Å2
Polarizability: 63.2±0.5 10-24cm3
Surface Tension: 48.7±3.0 dyne/cm
Molar Volume: 470.8±3.0 cm3

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