Found 1 result

Search term: XEAWTDQJPJUNNT-GQCREDPHSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 9-(5-O-Phosphono-L-ribofuranosyl)-2-(3-pyridinyl)-9H-purin-6-ol | C15H16N5O8P

9-(5-O-Phosphono-L-ribofuranosyl)-2-(3-pyridinyl)-9H-purin-6-ol

  • Molecular FormulaC15H16N5O8P
  • Average mass425.290 Da
  • Monoisotopic mass425.073639 Da
  • ChemSpider ID24659712

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

9-(5-O-Phosphono-L-ribofuranosyl)-2-(3-pyridinyl)-9H-purin-6-ol [German] [ACD/IUPAC Name]
9-(5-O-Phosphono-L-ribofuranosyl)-2-(3-pyridinyl)-9H-purin-6-ol [ACD/IUPAC Name]
9-(5-O-Phosphono-L-ribofuranosyl)-2-(3-pyridinyl)-9H-purin-6-ol [French] [ACD/IUPAC Name]
9H-Purin-6-ol, 9-(5-O-phosphono-L-ribofuranosyl)-2-(3-pyridinyl)- [ACD/Index Name]
Phosphoric acid mono-[3,4-dihydroxy-5-(6-oxo-2-pyridin-3-yl-1,6-dihydro-purin-9-yl)-tetrahydro-furan-2-ylmethyl] ester

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

Density: 2.1±0.1 g/cm3
Boiling Point: 702.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.9±3.0 kJ/mol
Flash Point: 378.5±35.7 °C
Index of Refraction: 1.851
Molar Refractivity: 92.4±0.5 cm3
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -0.38
ACD/LogD (pH 5.5): -6.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 203 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 112.0±7.0 dyne/cm
Molar Volume: 206.6±7.0 cm3

Click to predict properties on the Chemicalize site


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