ChemSpider 2D Image | 3-Hydroxy-2-(hydroxymethyl)-2-{[(4-oxo-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]amino}propyl dihydrogen phosphate | C11H17N4O7P

3-Hydroxy-2-(hydroxymethyl)-2-{[(4-oxo-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]amino}propyl dihydrogen phosphate

  • Molecular FormulaC11H17N4O7P
  • Average mass348.249 Da
  • Monoisotopic mass348.083496 Da
  • ChemSpider ID30823590

More details:

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

3-Hydroxy-2-(hydroxymethyl)-2-{[(4-oxo-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]amino}propyl dihydrogen phosphate [ACD/IUPAC Name]
3-Hydroxy-2-(hydroxymethyl)-2-{[(4-oxo-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]amino}propyldihydrogenphosphat [German] [ACD/IUPAC Name]
4H-Pyrrolo[3,2-d]pyrimidin-4-one, 3,5-dihydro-7-[[[2-hydroxy-1-(hydroxymethyl)-1-[(phosphonooxy)methyl]ethyl]amino]methyl]- [ACD/Index Name]
Dihydrogénophosphate de 3-hydroxy-2-(hydroxyméthyl)-2-{[(4-oxo-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)méthyl]amino}propyle [French] [ACD/IUPAC Name]

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: 1.722
Molar Refractivity: 74.2±0.5 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -2.28
ACD/LogD (pH 5.5): -5.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 186 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 97.2±7.0 dyne/cm
Molar Volume: 187.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement