ChemSpider 2D Image | 8-{(2E)-2-[1-(4-Ethylphenoxy)-2-propanylidene]hydrazino}-9-(alpha-L-lyxofuranosyl)-9H-purin-6-amine | C21H27N7O5

8-{(2E)-2-[1-(4-Ethylphenoxy)-2-propanylidene]hydrazino}-9-(α-L-lyxofuranosyl)-9H-purin-6-amine

  • Molecular FormulaC21H27N7O5
  • Average mass457.483 Da
  • Monoisotopic mass457.207367 Da
  • ChemSpider ID62472692
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres


More details:






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

8-{(2E)-2-[1-(4-Ethylphenoxy)-2-propanyliden]hydrazino}-9-(α-L-lyxofuranosyl)-9H-purin-6-amin [German] [ACD/IUPAC Name]
8-{(2E)-2-[1-(4-Ethylphenoxy)-2-propanylidene]hydrazino}-9-(α-L-lyxofuranosyl)-9H-purin-6-amine [ACD/IUPAC Name]
8-{(2E)-2-[1-(4-Éthylphénoxy)-2-propanylidène]hydrazino}-9-(α-L-lyxofuranosyl)-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 8-[(2E)-2-[2-(4-ethylphenoxy)-1-methylethylidene]hydrazinyl]-9-α-L-lyxofuranosyl- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 770.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 117.7±3.0 kJ/mol
Flash Point: 419.7±35.7 °C
Index of Refraction: 1.724
Molar Refractivity: 115.2±0.5 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 1.16
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 3.58
ACD/KOC (pH 5.5): 79.03
ACD/LogD (pH 7.4): 1.22
ACD/BCF (pH 7.4): 4.93
ACD/KOC (pH 7.4): 108.80
Polar Surface Area: 173 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 65.5±7.0 dyne/cm
Molar Volume: 290.5±7.0 cm3

Click to predict properties on the Chemicalize site






Advertisement