Found 1 result

Search term: FXURFKFOPCZEKG-UHFFFAOYSA-M (Found by InChIKey (full match))
ChemSpider 2D Image | 5,6-Dioxo-5,6-dihydro-1H-indole-2-carboxylate | C9H4NO4

5,6-Dioxo-5,6-dihydro-1H-indole-2-carboxylate

  • Molecular FormulaC9H4NO4
  • Average mass190.133 Da
  • Monoisotopic mass190.014587 Da
  • ChemSpider ID128919702

  • Charge - Charge

More details:

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

1H-Indole-2-carboxylic acid, 5,6-dihydro-5,6-dioxo-, ion(1-) [ACD/Index Name]
5,6-Dioxo-5,6-dihydro-1H-indol-2-carboxylat [German] [ACD/IUPAC Name]
5,6-Dioxo-5,6-dihydro-1H-indole-2-carboxylate [ACD/IUPAC Name]
5,6-Dioxo-5,6-dihydro-1H-indole-2-carboxylate [French] [ACD/IUPAC Name]
5,6-bis(oxidanylidene)-1H-indole-2-carboxylate
5,6-diketo-1H-indole-2-carboxylate
5,6-dioxo-1H-indole-2-carboxylate
5,6-indolequinone-2-carboxylate
ICQA
indole-5,6-quinone-2-carboxylate
  • Miscellaneous

    • Chemical Class:

      An indolecarboxylate that is the conjugate base of indole-5,6-quinone-2-carboxylic acid resulting from the deprotonation of the carboxy group. Major microspecies at pH 7.3. ChEBI CHEBI:177869

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

Density:
Boiling Point: 468.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 80.1±6.0 kJ/mol
Flash Point: 237.3±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -2.58
ACD/LogD (pH 5.5): -3.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 86 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement