ChemSpider 2D Image | 4-(2-[(2,6-Dibromo-3,4,5-trimethoxybenzoyl)amino]-3-{[2-(3,4-dimethoxyphenyl)-2-methylpropyl]amino}-3-oxopropyl)phenyl acetate | C33H38Br2N2O9

4-(2-[(2,6-Dibromo-3,4,5-trimethoxybenzoyl)amino]-3-{[2-(3,4-dimethoxyphenyl)-2-methylpropyl]amino}-3-oxopropyl)phenyl acetate

  • Molecular FormulaC33H38Br2N2O9
  • Average mass766.471 Da
  • Monoisotopic mass764.094421 Da
  • ChemSpider ID121039698

More details:

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

4-(2-[(2,6-Dibrom-3,4,5-trimethoxybenzoyl)amino]-3-{[2-(3,4-dimethoxyphenyl)-2-methylpropyl]amino}-3-oxopropyl)phenyl-acetat [German] [ACD/IUPAC Name]
4-(2-[(2,6-Dibromo-3,4,5-trimethoxybenzoyl)amino]-3-{[2-(3,4-dimethoxyphenyl)-2-methylpropyl]amino}-3-oxopropyl)phenyl acetate [ACD/IUPAC Name]
Acétate de 4-(2-[(2,6-dibromo-3,4,5-triméthoxybenzoyl)amino]-3-{[2-(3,4-diméthoxyphényl)-2-méthylpropyl]amino}-3-oxopropyl)phényle [French] [ACD/IUPAC Name]
Benzenepropanamide, 4-(acetyloxy)-α-[(2,6-dibromo-3,4,5-trimethoxybenzoyl)amino]-N-[2-(3,4-dimethoxyphenyl)-2-methylpropyl]- [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: 754.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.0±3.0 kJ/mol
Flash Point: 410.2±32.9 °C
Index of Refraction: 1.571
Molar Refractivity: 179.9±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 4.59
ACD/BCF (pH 5.5): 1801.44
ACD/KOC (pH 5.5): 7446.78
ACD/LogD (pH 7.4): 4.59
ACD/BCF (pH 7.4): 1800.34
ACD/KOC (pH 7.4): 7442.24
Polar Surface Area: 131 Å2
Polarizability: 71.3±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 547.4±3.0 cm3

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