ChemSpider 2D Image | N-[(2R)-1-(4-Hydroxy-3-iodophenyl)-2-propanyl]adenosine | C19H22IN5O5

N-[(2R)-1-(4-Hydroxy-3-iodophenyl)-2-propanyl]adenosine

  • Molecular FormulaC19H22IN5O5
  • Average mass527.313 Da
  • Monoisotopic mass527.066528 Da
  • ChemSpider ID30845455
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

Adenosine, N-[(1R)-2-(4-hydroxy-3-iodophenyl)-1-methylethyl]- [ACD/Index Name]
N-[(2R)-1-(4-Hydroxy-3-iodophenyl)-2-propanyl]adenosine [ACD/IUPAC Name]
N-[(2R)-1-(4-Hydroxy-3-iodophényl)-2-propanyl]adénosine [French] [ACD/IUPAC Name]
N-[(2R)-1-(4-Hydroxy-3-iodphenyl)-2-propanyl]adenosin [German] [ACD/IUPAC Name]
92530-58-0 [RN]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 766.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 117.1±3.0 kJ/mol
Flash Point: 417.4±35.7 °C
Index of Refraction: 1.796
Molar Refractivity: 113.4±0.5 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 2.38
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 18.28
ACD/KOC (pH 5.5): 277.91
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 17.27
ACD/KOC (pH 7.4): 262.55
Polar Surface Area: 146 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 73.3±7.0 dyne/cm
Molar Volume: 266.2±7.0 cm3

Click to predict properties on the Chemicalize site






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