ChemSpider 2D Image | 3-[(2R)-2-Ethoxypropyl]-2-thioxo-1,2,3,9-tetrahydro-6H-purin-6-one | C10H14N4O2S

3-[(2R)-2-Ethoxypropyl]-2-thioxo-1,2,3,9-tetrahydro-6H-purin-6-one

  • Molecular FormulaC10H14N4O2S
  • Average mass254.309 Da
  • Monoisotopic mass254.083740 Da
  • ChemSpider ID35033378
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

3-[(2R)-2-Ethoxypropyl]-2-thioxo-1,2,3,9-tetrahydro-6H-purin-6-on [German] [ACD/IUPAC Name]
3-[(2R)-2-Ethoxypropyl]-2-thioxo-1,2,3,9-tetrahydro-6H-purin-6-one [ACD/IUPAC Name]
3-[(2R)-2-Éthoxypropyl]-2-thioxo-1,2,3,9-tétrahydro-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one, 3-[(2R)-2-ethoxypropyl]-1,2,3,9-tetrahydro-2-thioxo- [ACD/Index Name]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.638
Molar Refractivity: 65.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.55
ACD/LogD (pH 5.5): 0.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 24.58
ACD/LogD (pH 7.4): -0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 22.73
Polar Surface Area: 102 Å2
Polarizability: 25.9±0.5 10-24cm3
Surface Tension: 74.7±5.0 dyne/cm
Molar Volume: 181.8±5.0 cm3

Click to predict properties on the Chemicalize site






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