ChemSpider 2D Image | N-{[9-(beta-D-Lyxofuranosyl)-8,9-dihydro-7H-purin-6-yl]carbamoyl}-L-threonine | C15H22N6O8

N-{[9-(β-D-Lyxofuranosyl)-8,9-dihydro-7H-purin-6-yl]carbamoyl}-L-threonine

  • Molecular FormulaC15H22N6O8
  • Average mass414.371 Da
  • Monoisotopic mass414.149902 Da
  • ChemSpider ID111313308

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

L-Threonine, N-[[(8,9-dihydro-9-β-D-lyxofuranosyl-7H-purin-6-yl)amino]carbonyl]- [ACD/Index Name]
N-{[9-(β-D-Lyxofuranosyl)-8,9-dihydro-7H-purin-6-yl]carbamoyl}-L-threonin [German] [ACD/IUPAC Name]
N-{[9-(β-D-Lyxofuranosyl)-8,9-dihydro-7H-purin-6-yl]carbamoyl}-L-threonine [ACD/IUPAC Name]
N-{[9-(β-D-Lyxofuranosyl)-8,9-dihydro-7H-purin-6-yl]carbamoyl}-L-thréonine [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 785.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.8±3.0 kJ/mol
Flash Point: 428.7±32.9 °C
Index of Refraction: 1.709
Molar Refractivity: 94.6±0.3 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -0.50
ACD/LogD (pH 5.5): -3.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 210 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 111.6±3.0 dyne/cm
Molar Volume: 242.3±3.0 cm3

Click to predict properties on the Chemicalize site


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