ChemSpider 2D Image | 2-[(Dichloroacetyl)amino]-3-hydroxy-1-(4-nitrophenyl)propyl palmitate | C27H42Cl2N2O6

2-[(Dichloroacetyl)amino]-3-hydroxy-1-(4-nitrophenyl)propyl palmitate

  • Molecular FormulaC27H42Cl2N2O6
  • Average mass561.538 Da
  • Monoisotopic mass560.242004 Da
  • ChemSpider ID128912746

More details:

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

2-[(Dichloracetyl)amino]-3-hydroxy-1-(4-nitrophenyl)propylpalmitat [German] [ACD/IUPAC Name]
2-[(Dichloroacetyl)amino]-3-hydroxy-1-(4-nitrophenyl)propyl palmitate [ACD/IUPAC Name]
Hexadecanoic acid, 2-[(2,2-dichloroacetyl)amino]-3-hydroxy-1-(4-nitrophenyl)propyl ester [ACD/Index Name]
Palmitate de 2-[(2,2-dichloroacétyl)amino]-3-hydroxy-1-(4-nitrophényl)propyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 680.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.8±3.0 kJ/mol
Flash Point: 365.1±31.5 °C
Index of Refraction: 1.526
Molar Refractivity: 146.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 2
ACD/LogP: 8.94
ACD/LogD (pH 5.5): 9.14
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2245088.50
ACD/LogD (pH 7.4): 9.14
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2243780.00
Polar Surface Area: 121 Å2
Polarizability: 58.2±0.5 10-24cm3
Surface Tension: 45.0±3.0 dyne/cm
Molar Volume: 478.9±3.0 cm3

Click to predict properties on the Chemicalize site


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