ChemSpider 2D Image | 5-(beta-Carboxyethyl)-4,6-dihydroxypicolinate | C9H8NO6

5-(β-Carboxyethyl)-4,6-dihydroxypicolinate

  • Molecular FormulaC9H8NO6
  • Average mass226.163 Da
  • Monoisotopic mass226.035706 Da
  • ChemSpider ID20016014

  • Charge - Charge

More details:

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

3-Pyridinepropanoic acid, 6-carboxy-1,2-dihydro-4-hydroxy-2-oxo-, ion(1-) [ACD/Index Name]
5-(2-Carboxyethyl)-4-hydroxy-6-oxo-1,6-dihydro-2-pyridincarboxylat [German] [ACD/IUPAC Name]
5-(2-Carboxyethyl)-4-hydroxy-6-oxo-1,6-dihydro-2-pyridinecarboxylate [ACD/IUPAC Name]
5-(2-Carboxyéthyl)-4-hydroxy-6-oxo-1,6-dihydro-2-pyridinecarboxylate [French] [ACD/IUPAC Name]
5-(β-Carboxyethyl)-4,6-dihydroxypicolinate
5-(2'-Carboxyethyl)-4,6-dihydroxypicolinate
5-(2-carboxyethyl)-4-hydroxy-6-oxo-1,6-dihydropyridine-2-carboxylate
  • Miscellaneous

    • Chemical Class:

      An oxo carboxylic acid anion that is the conjugate base of 5-(2'-carboxyethyl)-4,6-dihydroxypicolinic acid. ChEBI CHEBI:2009

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

Density:
Boiling Point: 805.4±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 122.8±0.0 kJ/mol
Flash Point: 440.9±0.0 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -3.18
ACD/LogD (pH 5.5): -7.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 131 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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