ChemSpider 2D Image | 2-Amino-9-{[(1,3-dihydroxy-2-propanyl)oxy]methyl}(8-~3~H)-3,9-dihydro-6H-purin-6-one | C9H12TN5O4

2-Amino-9-{[(1,3-dihydroxy-2-propanyl)oxy]methyl}(8-3H)-3,9-dihydro-6H-purin-6-one

  • Molecular FormulaC9H12TN5O4
  • Average mass257.239 Da
  • Monoisotopic mass257.104980 Da
  • ChemSpider ID58825516
  • Non-standard isotope - Non-standard isotope


More details:






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

2-Amino-9-{[(1,3-dihydroxy-2-propanyl)oxy]methyl}(8-3H)-3,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-Amino-9-{[(1,3-dihydroxy-2-propanyl)oxy]methyl}(8-3H)-3,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-Amino-9-{[(1,3-dihydroxy-2-propanyl)oxy]méthyl}(8-3H)-3,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one-8-t, 2-amino-3,9-dihydro-9-[[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl]- [ACD/Index Name]
Ganclclovir, [8-3H]

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

CCRIS 4693 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point: 675.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.1±3.0 kJ/mol
Flash Point: 362.0±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -2.07
ACD/LogD (pH 5.5): -1.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.20
ACD/LogD (pH 7.4): -1.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.21
Polar Surface Area: 135 Å2
Polarizability:
Surface Tension:
Molar Volume:

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