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Search term: MYNHYKDPSRPBNZ-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-(4-Oxo-4,5-dihydro-1H-imidazol-3-ium-5-id-5-yl)propanoate | C6H7N2O3

3-(4-Oxo-4,5-dihydro-1H-imidazol-3-ium-5-id-5-yl)propanoate

  • Molecular FormulaC6H7N2O3
  • Average mass155.132 Da
  • Monoisotopic mass155.046219 Da
  • ChemSpider ID31150424

  • Charge - Charge

More details:

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

1H-Imidazole-5-propanoic acid, 4,5-dihydro-4-oxo-, inner salt, ion(1-) [ACD/Index Name]
3-(4-Oxo-4,5-dihydro-1H-imidazol-3-ium-5-id-5-yl)propanoat [German] [ACD/IUPAC Name]
3-(4-Oxo-4,5-dihydro-1H-imidazol-3-ium-5-id-5-yl)propanoate [ACD/IUPAC Name]
3-(4-Oxo-4,5-dihydro-1H-imidazol-3-ium-5-id-5-yl)propanoate [French] [ACD/IUPAC Name]
3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoate(1-)
4-imidazolone-5-propanoate
  • Miscellaneous

    • Chemical Class:

      A monocarboxylic acid anion that is the conjugate base of 3-(4-oxo-4,5-dihydro-1H-imidazol-5-yl)propanoic acid and the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). ChEBI CHEBI:77893

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 83 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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