ChemSpider 2D Image | PSI 7411 | C10H14FN2O8P

ψ 7411

  • Molecular FormulaC10H14FN2O8P
  • Average mass340.199 Da
  • Monoisotopic mass340.047180 Da
  • ChemSpider ID24625559

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

{[(2R,3R,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-fluoro-3-hydroxy-4-methyloxolan-2-yl]methoxy}phosphonic acid
1-(2-Deoxy-2-fluoro-2-methyl-5-O-phosphonopentofuranosyl)-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-(2-Desoxy-2-fluor-2-methyl-5-O-phosphonopentofuranosyl)-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-(2-Désoxy-2-fluoro-2-méthyl-5-O-phosphonopentofuranosyl)-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
1015073-43-4 [RN]
2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-2-fluoro-2-methyl-5-O-phosphonopentofuranosyl)- [ACD/Index Name]
OOL8KAC85O
ψ 7411
ψ-7411
[(2R,3R,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-fluoro-3-hydroxy-4-methyloxolan-2-yl]methyl dihydrogen phosphate
More...

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.597
Molar Refractivity: 66.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.11
ACD/LogD (pH 5.5): -5.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 155 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 80.0±5.0 dyne/cm
Molar Volume: 196.1±5.0 cm3

Click to predict properties on the Chemicalize site


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