ChemSpider 2D Image | 1-{5-O-[({[2,3-Bis(stearoyloxy)propoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]pentofuranosyl}-4-imino-3,4-dihydro-2(1H)-pyrimidinone | C48H89N3O15P2

1-{5-O-[({[2,3-Bis(stearoyloxy)propoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]pentofuranosyl}-4-imino-3,4-dihydro-2(1H)-pyrimidinone

  • Molecular FormulaC48H89N3O15P2
  • Average mass1010.179 Da
  • Monoisotopic mass1009.576904 Da
  • ChemSpider ID95640134

More details:

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

1-{5-O-[({[2,3-Bis(stearoyloxy)propoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]pentofuranosyl}-4-imino-3,4-dihydro-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
1-{5-O-[({[2,3-Bis(stearoyloxy)propoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]pentofuranosyl}-4-imino-3,4-dihydro-2(1H)-pyrimidinone [ACD/IUPAC Name]
1-{5-O-[({[2,3-Bis(stearoyloxy)propoxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]pentofuranosyl}-4-imino-3,4-dihydro-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]
2(1H)-Pyrimidinone, 1-[5-O-[[[[2,3-bis[(1-oxooctadecyl)oxy]propoxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]pentofuranosyl]-3,4-dihydro-4-imino- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.546
Molar Refractivity: 257.0±0.5 cm3
#H bond acceptors: 18
#H bond donors: 6
#Freely Rotating Bonds: 46
#Rule of 5 Violations: 4
ACD/LogP: 13.24
ACD/LogD (pH 5.5): 7.66
ACD/BCF (pH 5.5): 56984.33
ACD/KOC (pH 5.5): 8992.01
ACD/LogD (pH 7.4): 7.63
ACD/BCF (pH 7.4): 52866.88
ACD/KOC (pH 7.4): 8342.29
Polar Surface Area: 280 Å2
Polarizability: 101.9±0.5 10-24cm3
Surface Tension: 49.8±7.0 dyne/cm
Molar Volume: 810.9±7.0 cm3

Click to predict properties on the Chemicalize site


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