ChemSpider 2D Image | Ethyl 2-methyl-2-(3-nitrophenyl)propanoate | C12H15NO4

Ethyl 2-methyl-2-(3-nitrophenyl)propanoate

  • Molecular FormulaC12H15NO4
  • Average mass237.252 Da
  • Monoisotopic mass237.100113 Da
  • ChemSpider ID63000485

More details:

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

2-Méthyl-2-(3-nitrophényl)propanoate d'éthyle [French] [ACD/IUPAC Name]
Benzeneacetic acid, α,α-dimethyl-3-nitro-, ethyl ester [ACD/Index Name]
Ethyl 2-methyl-2-(3-nitrophenyl)propanoate [ACD/IUPAC Name]
Ethyl-2-methyl-2-(3-nitrophenyl)propanoat [German] [ACD/IUPAC Name]
266314-50-5 [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: 313.0±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 121.1±22.9 °C
Index of Refraction: 1.521
Molar Refractivity: 62.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 3.11
ACD/BCF (pH 5.5): 136.46
ACD/KOC (pH 5.5): 1174.46
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 136.46
ACD/KOC (pH 7.4): 1174.46
Polar Surface Area: 72 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 40.3±3.0 dyne/cm
Molar Volume: 204.5±3.0 cm3

Click to predict properties on the Chemicalize site


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