ChemSpider 2D Image | 2-Amino-9-{4-[hydroxy(~2~H_2_)methyl]-2-cyclopenten-1-yl}-3,9-dihydro-6H-purin-6-one | C11H11D2N5O2

2-Amino-9-{4-[hydroxy(2H2)methyl]-2-cyclopenten-1-yl}-3,9-dihydro-6H-purin-6-one

  • Molecular FormulaC11H11D2N5O2
  • Average mass249.266 Da
  • Monoisotopic mass249.119476 Da
  • ChemSpider ID78057737

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Amino-9-{4-[hydroxy(2H2)methyl]-2-cyclopenten-1-yl}-3,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
2-Amino-9-{4-[hydroxy(2H2)methyl]-2-cyclopenten-1-yl}-3,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
2-Amino-9-{4-[hydroxy(2H2)méthyl]-2-cyclopentén-1-yl}-3,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one, 2-amino-3,9-dihydro-9-[4-(hydroxymethyl-d2)-2-cyclopenten-1-yl]- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 605.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.7±3.0 kJ/mol
Flash Point: 320.1±34.3 °C
Index of Refraction: 1.842
Molar Refractivity: 62.3±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.40
ACD/LogD (pH 5.5): -0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.95
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.32
Polar Surface Area: 106 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 85.1±7.0 dyne/cm
Molar Volume: 140.5±7.0 cm3

Click to predict properties on the Chemicalize site


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