ChemSpider 2D Image | (7R,18S,19R)-18,19-Dibromo-7-{[(9S,10S)-9,10-dibromooctadecanoyl]oxy}-4-hydroxy-N,N,N-trimethyl-10-oxo-3,5,9-trioxa-4-phosphaheptacosan-1-aminium 4-oxide | C44H85Br4NO8P

(7R,18S,19R)-18,19-Dibromo-7-{[(9S,10S)-9,10-dibromooctadecanoyl]oxy}-4-hydroxy-N,N,N-trimethyl-10-oxo-3,5,9-trioxa-4-phosphaheptacosan-1-aminium 4-oxide

  • Molecular FormulaC44H85Br4NO8P
  • Average mass1106.737 Da
  • Monoisotopic mass1102.274048 Da
  • ChemSpider ID13168794

  • Charge - Charge

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(7R,18S,19R) 4-Oxyde de 18,19-dibromo-7-{[(9S,10S)-9,10-dibromooctadecanoyl]oxy}-4-hydroxy-N,N,N-triméthyl-10-oxo-3,5,9-trioxa-4-phosphaheptacosan-1-aminium [French] [ACD/IUPAC Name]
(7R,18S,19R)-18,19-Dibrom-7-{[(9S,10S)-9,10-dibromoctadecanoyl]oxy}-4-hydroxy-N,N,N-trimethyl-10-oxo-3,5,9-trioxa-4-phosphaheptacosan-1-aminium-4-oxid [German] [ACD/IUPAC Name]
(7R,18S,19R)-18,19-Dibromo-7-{[(9S,10S)-9,10-dibromooctadecanoyl]oxy}-4-hydroxy-N,N,N-trimethyl-10-oxo-3,5,9-trioxa-4-phosphaheptacosan-1-aminium 4-oxide [ACD/IUPAC Name]
Ethanaminium, 2-[[[(2R)-3-[[(9S,10R)-9,10-dibromo-1-oxooctadecyl]oxy]-2-[[(9S,10S)-9,10-dibromo-1-oxooctadecyl]oxy]propoxy]hydroxyphosphinyl]oxy]-N,N,N-trimethyl- [ACD/Index 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: 9
#H bond donors: 1
#Freely Rotating Bonds: 44
#Rule of 5 Violations: 2
ACD/LogP: 12.79
ACD/LogD (pH 5.5): 11.51
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.51
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 118 Å2
Polarizability:
Surface Tension:
Molar Volume:

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