ChemSpider 2D Image | 3-(Benzyloxy)-1-(2,3-dihydroxypropyl)-4-oxo-1,4-dihydro-2-pyridinecarboxylic acid | C16H17NO6

3-(Benzyloxy)-1-(2,3-dihydroxypropyl)-4-oxo-1,4-dihydro-2-pyridinecarboxylic acid

  • Molecular FormulaC16H17NO6
  • Average mass319.309 Da
  • Monoisotopic mass319.105591 Da
  • ChemSpider ID26518541

More details:

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

1206102-06-8 [RN]
2-Pyridinecarboxylic acid, 1-(2,3-dihydroxypropyl)-1,4-dihydro-4-oxo-3-(phenylmethoxy)- [ACD/Index Name]
3-(Benzyloxy)-1-(2,3-dihydroxypropyl)-4-oxo-1,4-dihydro-2-pyridincarbonsäure [German] [ACD/IUPAC Name]
3-(Benzyloxy)-1-(2,3-dihydroxypropyl)-4-oxo-1,4-dihydro-2-pyridinecarboxylic acid [ACD/IUPAC Name]
3-(Benzyloxy)-1-(2,3-dihydroxypropyl)-4-oxo-1,4-dihydropyridine-2-carboxylic acid
Acide 3-(benzyloxy)-1-(2,3-dihydroxypropyl)-4-oxo-1,4-dihydro-2-pyridinecarboxylique [French] [ACD/IUPAC Name]
1-(2,3-dihydroxypropyl)-4-oxo-3-[(phenylmethyl)oxy]-1,4-dihydro-2-pyridinecarboxylic acid
1-(2,3-dihydroxypropyl)-4-oxo-3-phenylmethoxypyridine-2-carboxylic acid
1206102-07-9 [RN]
3-Benzyloxy-1-(2,3-dihydroxy-propyl)-4-oxo-1,4-dihydro-pyridine-2-carboxylic acid
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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: 543.5±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 86.5±3.0 kJ/mol
    Flash Point: 282.5±30.1 °C
    Index of Refraction: 1.651
    Molar Refractivity: 80.8±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: -1.30
    ACD/LogD (pH 5.5): -3.01
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.37
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 107 Å2
    Polarizability: 32.0±0.5 10-24cm3
    Surface Tension: 73.9±5.0 dyne/cm
    Molar Volume: 221.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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