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ChemSpider 2D Image | [3-Hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methanaminium | C8H13N2O2


  • Molecular FormulaC8H13N2O2
  • Average mass169.201 Da
  • Monoisotopic mass169.097153 Da
  • ChemSpider ID26330902
  • Charge - Charge

More details:

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

[3-Hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methanaminium [German] [ACD/IUPAC Name]
[3-Hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methanaminium [ACD/IUPAC Name]
[3-Hydroxy-5-(hydroxyméthyl)-2-méthyl-4-pyridinyl]méthanaminium [French] [ACD/IUPAC Name]
3-Pyridinemethanol, 4-(aminomethyl)-5-hydroxy-6-methyl-, conjugate monoacid [ACD/Index Name]
Pm [Formula]
pyridoxaminium cation
  • Miscellaneous
    • Chemical Class:

      An ammonium ion that is the conjugate acid of pyridoxamine arising from selective protonation of the primary amino group; major species at pH 7.3. ChEBI CHEBI:57761

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

Boiling Point: 460.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 232.1±27.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.04
ACD/LogD (pH 5.5): -2.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.57
Polar Surface Area: 81 Å2
Surface Tension:
Molar Volume:

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