ChemSpider 2D Image | Methyl 2-chloro-4-methylnicotinate | C8H8ClNO2

Methyl 2-chloro-4-methylnicotinate

  • Molecular FormulaC8H8ClNO2
  • Average mass185.608 Da
  • Monoisotopic mass185.024353 Da
  • ChemSpider ID16027869

More details:

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

2-Chloro-4-méthylnicotinate de méthyle [French] [ACD/IUPAC Name]
3-Pyridinecarboxylic acid, 2-chloro-4-methyl-, methyl ester [ACD/Index Name]
Methyl 2-chloro-4-methylnicotinate [ACD/IUPAC Name]
Methyl-2-chlor-4-methylnicotinat [German] [ACD/IUPAC Name]
217811-63-7 [RN]
2-Chloro-4-methyl-nicotinic acid methyl ester
95%
AGN-PC-01MMO6
AKOS022182578
methyl 2-chloro-4-methyl nicotinate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 258.2±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.6±3.0 kJ/mol
    Flash Point: 109.9±25.9 °C
    Index of Refraction: 1.528
    Molar Refractivity: 45.8±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.70
    ACD/LogD (pH 5.5): 1.81
    ACD/BCF (pH 5.5): 13.97
    ACD/KOC (pH 5.5): 229.79
    ACD/LogD (pH 7.4): 1.81
    ACD/BCF (pH 7.4): 13.97
    ACD/KOC (pH 7.4): 229.79
    Polar Surface Area: 39 Å2
    Polarizability: 18.2±0.5 10-24cm3
    Surface Tension: 42.5±3.0 dyne/cm
    Molar Volume: 148.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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