ChemSpider 2D Image | 5-Ethyl 1-methyl 2-(acetoxymethyl)-2-nitropentanedioate | C11H17NO8

5-Ethyl 1-methyl 2-(acetoxymethyl)-2-nitropentanedioate

  • Molecular FormulaC11H17NO8
  • Average mass291.255 Da
  • Monoisotopic mass291.095428 Da
  • ChemSpider ID35792774

More details:

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

2-(Acétoxyméthyl)-2-nitropentanedioate de 5-éthyle et de 1-méthyle [French] [ACD/IUPAC Name]
5-Ethyl 1-methyl 2-(acetoxymethyl)-2-nitropentanedioate [ACD/IUPAC Name]
5-Ethyl-1-methyl-2-(acetoxymethyl)-2-nitropentandioat [German] [ACD/IUPAC Name]
Pentanedioic acid, 2-[(acetyloxy)methyl]-2-nitro-, 5-ethyl 1-methyl ester [ACD/Index Name]
5-Ethyl 1-methyl 2-[(acetyloxy)methyl]-2-nitropentanedioate
88239-01-4 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 320.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.2±3.0 kJ/mol
Flash Point: 112.7±29.9 °C
Index of Refraction: 1.463
Molar Refractivity: 64.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 2.16
ACD/BCF (pH 5.5): 25.79
ACD/KOC (pH 5.5): 356.37
ACD/LogD (pH 7.4): 2.16
ACD/BCF (pH 7.4): 25.79
ACD/KOC (pH 7.4): 356.37
Polar Surface Area: 125 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 43.0±3.0 dyne/cm
Molar Volume: 233.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement