ChemSpider 2D Image | Ethyl 2-(4-nitrobenzoyl)benzoate | C16H13NO5

Ethyl 2-(4-nitrobenzoyl)benzoate

  • Molecular FormulaC16H13NO5
  • Average mass299.278 Da
  • Monoisotopic mass299.079376 Da
  • ChemSpider ID21397492

More details:






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

2-(4-Nitrobenzoyl)benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-(4-nitrobenzoyl)-, ethyl ester [ACD/Index Name]
Ethyl 2-(4-nitrobenzoyl)benzoate [ACD/IUPAC Name]
Ethyl-2-(4-nitrobenzoyl)benzoat [German] [ACD/IUPAC Name]
[760192-93-6]
2-ethoxycarbonyl-4-nitrobenzophenone
2-Ethoxycarbonyl-4'-nitrobenzophenone
760192-93-6 [RN]
MFCD02260407 [MDL number]
  • Miscellaneous

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 447.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 189.0±25.2 °C
Index of Refraction: 1.591
Molar Refractivity: 79.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 3.25
ACD/BCF (pH 5.5): 174.07
ACD/KOC (pH 5.5): 1398.06
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 174.07
ACD/KOC (pH 7.4): 1398.06
Polar Surface Area: 89 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 51.7±3.0 dyne/cm
Molar Volume: 233.8±3.0 cm3

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