ChemSpider 2D Image | 2-Chloro-4-pivalamidonicotinic acid | C11H13ClN2O3

2-Chloro-4-pivalamidonicotinic acid

  • Molecular FormulaC11H13ClN2O3
  • Average mass256.685 Da
  • Monoisotopic mass256.061462 Da
  • ChemSpider ID21331045

More details:

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

1021339-24-1 [RN]
2-Chlor-4-[(2,2-dimethylpropanoyl)amino]nicotinsäure [German] [ACD/IUPAC Name]
2-Chloro-4-(2,2-dimethylpropanamido)pyridine-3-carboxylic acid
2-Chloro-4-[(2,2-dimethyl-1-oxopropyl)amino]-3-pyridinecarboxylic acid
2-Chloro-4-[(2,2-dimethylpropanoyl)amino]nicotinic acid [ACD/IUPAC Name]
2-Chloro-4-pivalamidonicotinic acid
3-Pyridinecarboxylic acid, 2-chloro-4-[(2,2-dimethyl-1-oxopropyl)amino]- [ACD/Index Name]
Acide 2-chloro-4-[(2,2-diméthylpropanoyl)amino]nicotinique [French] [ACD/IUPAC Name]
MFCD09965898 [MDL number]
[1021339-24-1] [RN]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 461.2±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.1±3.0 kJ/mol
    Flash Point: 232.7±28.7 °C
    Index of Refraction: 1.593
    Molar Refractivity: 64.3±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.71
    ACD/LogD (pH 5.5): -0.39
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.44
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 79 Å2
    Polarizability: 25.5±0.5 10-24cm3
    Surface Tension: 55.3±3.0 dyne/cm
    Molar Volume: 189.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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