ChemSpider 2D Image | Ethyl 4-(hydroxymethyl)-6-methylnicotinate | C10H13NO3

Ethyl 4-(hydroxymethyl)-6-methylnicotinate

  • Molecular FormulaC10H13NO3
  • Average mass195.215 Da
  • Monoisotopic mass195.089539 Da
  • ChemSpider ID21118000

More details:

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

3-Pyridinecarboxylic acid, 4-(hydroxymethyl)-6-methyl-, ethyl ester [ACD/Index Name]
4-(Hydroxyméthyl)-6-méthylnicotinate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-(hydroxymethyl)-6-methylnicotinate [ACD/IUPAC Name]
Ethyl-4-(hydroxymethyl)-6-methylnicotinat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 337.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.3±3.0 kJ/mol
Flash Point: 158.2±27.9 °C
Index of Refraction: 1.535
Molar Refractivity: 52.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.69
ACD/LogD (pH 5.5): 1.00
ACD/BCF (pH 5.5): 3.35
ACD/KOC (pH 5.5): 81.98
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 3.44
ACD/KOC (pH 7.4): 84.32
Polar Surface Area: 59 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 167.1±3.0 cm3

Click to predict properties on the Chemicalize site


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