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Search term: NTYJJOPFIAHURM-UHFFFAOYSA-O (Found by InChIKey (full match))

ChemSpider 2D Image | 2-(1H-Imidazol-4-yl)ethanaminium | C5H10N3


  • Molecular FormulaC5H10N3
  • Average mass112.152 Da
  • Monoisotopic mass112.086922 Da
  • ChemSpider ID21494290
  • Charge - Charge

More details:

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

1H-Imidazole-4-ethanamine, conjugate monoacid [ACD/Index Name]
2-(1H-Imidazol-4-yl)ethanaminium [ACD/IUPAC Name]
2-(1H-Imidazol-4-yl)ethanaminium [German] [ACD/IUPAC Name]
2-(1H-Imidazol-4-yl)éthanaminium [French] [ACD/IUPAC Name]
1H-Imidazole-4-ethanamine [ACD/Index Name]
Histamine [Wiki]
histaminium cation
  • Miscellaneous
    • Chemical Class:

      An ammonium ion that is the conjugate acid of histamine protonated on the side-chain nitrogen. ChEBI CHEBI:58432

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

Boiling Point: 380.3±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.8±3.0 kJ/mol
Flash Point: 180.3±8.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.92
ACD/LogD (pH 5.5): -4.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 56 Å2
Surface Tension:
Molar Volume:

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