ChemSpider 2D Image | [[(2~{r},3~{s},4~{r},5~{r})-5-[2,4-Bis(Oxidanylidene)pyrimidin-1-Yl]-3,4-Bis(Oxidanyl)oxolan-2-Yl]methoxy-Oxidanyl-Phosphoryl]oxy-[[(2~{s},3~{r},4~{s},5~{s},6~{r})-6-(Hydroxymethyl)-3,4,5-Tris(Oxidanyl)oxan-2-Yl]methyl]phosphinic Acid | C16H26N2O16P2

[[(2{r},3{s},4{r},5{r})-5-[2,4-Bis(Oxidanylidene)pyrimidin-1-Yl]-3,4-Bis(Oxidanyl)oxolan-2-Yl]methoxy-Oxidanyl-Phosphoryl]oxy-[[(2{s},3{r},4{s},5{s},6~{r})-6-(Hydroxymethyl)-3,4,5-Tris(Oxidanyl)oxan-2-Yl]methyl]phosphinic Acid

  • Molecular FormulaC16H26N2O16P2
  • Average mass564.329 Da
  • Monoisotopic mass564.075745 Da
  • ChemSpider ID59053621
  • defined stereocentres - 9 of 9 defined stereocentres


More details:






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

[[(2{r},3{s},4{r},5{r})-5-[2,4-Bis(Oxidanylidene)pyrimidin-1-Yl]-3,4-Bis(Oxidanyl)oxolan-2-Yl]methoxy-Oxidanyl-Phosphoryl]oxy-[[(2{s},3{r},4{s},5{s},6~{r})-6-(Hydroxymethyl)-3,4,5-Tris(Oxidanyl)oxan-2-Yl]methyl]phosphinic Acid

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

660 [DBID]

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

Density: 1.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.642
Molar Refractivity: 109.8±0.3 cm3
#H bond acceptors: 18
#H bond donors: 9
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -5.45
ACD/LogD (pH 5.5): -10.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 302 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 106.8±3.0 dyne/cm
Molar Volume: 303.9±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement