ChemSpider 2D Image | 4-(1,3-Dioxan-2-yl)-2-nitrophenyl methyl succinate | C15H17NO8

4-(1,3-Dioxan-2-yl)-2-nitrophenyl methyl succinate

  • Molecular FormulaC15H17NO8
  • Average mass339.297 Da
  • Monoisotopic mass339.095428 Da
  • ChemSpider ID28804012

More details:

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

4-(1,3-Dioxan-2-yl)-2-nitrophenyl methyl succinate [ACD/IUPAC Name]
4-(1,3-Dioxan-2-yl)-2-nitrophenyl-methyl-succinat [German] [ACD/IUPAC Name]
Butanedioic acid, 4-(1,3-dioxan-2-yl)-2-nitrophenyl methyl ester [ACD/Index Name]
Succinate de 4-(1,3-dioxan-2-yl)-2-nitrophényle et de méthyle [French] [ACD/IUPAC 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: 489.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.6±3.0 kJ/mol
Flash Point: 206.4±30.7 °C
Index of Refraction: 1.537
Molar Refractivity: 79.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.51
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 16.30
ACD/KOC (pH 5.5): 256.58
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 16.30
ACD/KOC (pH 7.4): 256.58
Polar Surface Area: 117 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 255.2±3.0 cm3

Click to predict properties on the Chemicalize site


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