ChemSpider 2D Image | Aeruginascin | C13H19N2O4P


  • Molecular FormulaC13H19N2O4P
  • Average mass298.275 Da
  • Monoisotopic mass298.108246 Da
  • ChemSpider ID26233970

More details:

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

1H-Indole-3-ethanaminium, N,N,N-trimethyl-4-(phosphonooxy)-, inner salt [ACD/Index Name]
3-[2-(Trimethylammonio)ethyl]-1H-indol-4-yl hydrogen phosphate [ACD/IUPAC Name]
3-[2-(Trimethylammonio)ethyl]-1H-indol-4-ylhydrogenphosphat [German] [ACD/IUPAC Name]
Aeruginascin [Wiki]
Hydrogénophosphate de 3-[2-(triméthylammonio)éthyl]-1H-indol-4-yle [French] [ACD/IUPAC Name]
114264-95-8 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -3.81
ACD/LogD (pH 5.5): -3.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Surface Tension:
Molar Volume:

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