ChemSpider 2D Image | 4,4-Dihydroxy-2-{[(1E)-1-hydroxy-1-hexadecen-1-yl]oxy}-N,N,N-trimethyl-3-buten-1-aminium | C23H46NO4

4,4-Dihydroxy-2-{[(1E)-1-hydroxy-1-hexadecen-1-yl]oxy}-N,N,N-trimethyl-3-buten-1-aminium

  • Molecular FormulaC23H46NO4
  • Average mass400.615 Da
  • Monoisotopic mass400.342133 Da
  • ChemSpider ID95772706

  • Charge - Charge

More details:

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

3-Buten-1-aminium, 4,4-dihydroxy-2-[[(1E)-1-hydroxy-1-hexadecen-1-yl]oxy]-N,N,N-trimethyl- [ACD/Index Name]
4,4-Dihydroxy-2-{[(1E)-1-hydroxy-1-hexadecen-1-yl]oxy}-N,N,N-trimethyl-3-buten-1-aminium [German] [ACD/IUPAC Name]
4,4-Dihydroxy-2-{[(1E)-1-hydroxy-1-hexadecen-1-yl]oxy}-N,N,N-trimethyl-3-buten-1-aminium [ACD/IUPAC Name]
4,4-Dihydroxy-2-{[(1E)-1-hydroxy-1-hexadécén-1-yl]oxy}-N,N,N-triméthyl-3-butén-1-aminium [French] [ACD/IUPAC Name]

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: 3
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 5.07
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 100.80
ACD/KOC (pH 5.5): 945.95
ACD/LogD (pH 7.4): 2.99
ACD/BCF (pH 7.4): 112.52
ACD/KOC (pH 7.4): 1055.97
Polar Surface Area: 70 Å2
Polarizability:
Surface Tension:
Molar Volume:

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