ChemSpider 2D Image | Ethyl Nicotinate-2,4,5,6-d4 | C8H5D4NO2

Ethyl Nicotinate-2,4,5,6-d4

  • Molecular FormulaC8H5D4NO2
  • Average mass155.187 Da
  • Monoisotopic mass155.088440 Da
  • ChemSpider ID24532556

  • Non-standard isotope - Non-standard isotope

More details:

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

3-(2H4)Pyridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
3-Pyridine-d4-carboxylic acid, ethyl ester [ACD/Index Name]
66148-16-1 [RN]
Ethyl (2H4)pyridine-3-carboxylate
Ethyl 3-(2H4)pyridinecarboxylate [ACD/IUPAC Name]
Ethyl 3-pyridine-2,4,5,6-d4-carboxylate
Ethyl Nicotinate-2,4,5,6-d4
Ethyl-3-(2H4)pyridincarboxylat [German] [ACD/IUPAC Name]
ethyl 2,4,5,6-tetradeuteriopyridine-3-carboxylate
Ethyl 3-pyridinecarboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 224.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.0±3.0 kJ/mol
Flash Point: 93.3±0.0 °C
Index of Refraction: 1.506
Molar Refractivity: 40.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 1.22
ACD/BCF (pH 5.5): 5.01
ACD/KOC (pH 5.5): 110.11
ACD/LogD (pH 7.4): 1.23
ACD/BCF (pH 7.4): 5.04
ACD/KOC (pH 7.4): 110.79
Polar Surface Area: 39 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 40.6±3.0 dyne/cm
Molar Volume: 137.1±3.0 cm3

Click to predict properties on the Chemicalize site


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