ChemSpider 2D Image | 2-Oxido-1,2,3-propanetricarboxylate | C6H4O7

2-Oxido-1,2,3-propanetricarboxylate

  • Molecular FormulaC6H4O7
  • Average mass188.094 Da
  • Monoisotopic mass187.997894 Da
  • ChemSpider ID34552020

  • Charge - Charge

More details:

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

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, ion(4-) [ACD/Index Name]
2-Oxido-1,2,3-propanetricarboxylate [ACD/IUPAC Name]
2-Oxido-1,2,3-propantricarboxylat [German] [ACD/IUPAC Name]
2-Oxydo-1,2,3-propanetricarboxylate [French] [ACD/IUPAC Name]
2-oxidopropane-1,2,3-tricarboxylate
citrate(4-)
citric acid tetraanion
  • Miscellaneous

    • Chemical Class:

      A citrate anion obtained by deprotonation of the three carboxy groups as well as the hydroxy group of citric acid. ChEBI CHEBI:132362

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

Density:
Boiling Point: 309.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 63.8±6.0 kJ/mol
Flash Point: 155.2±24.4 °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: -1.72
ACD/LogD (pH 5.5): -6.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 143 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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