Found 8 results

Search term: HPHXOIULGYVAKW (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 9-[(2xi)-2-O-Methyl-beta-L-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one | C11H14N4O5

9-[(2ξ)-2-O-Methyl-β-L-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one

  • Molecular FormulaC11H14N4O5
  • Average mass282.253 Da
  • Monoisotopic mass282.096405 Da
  • ChemSpider ID58825459

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

6H-Purin-6-one, 1,9-dihydro-9-[(2ξ)-2-O-methyl-β-L-threo-pentofuranosyl]- [ACD/Index Name]
9-[(2ξ)-2-O-Methyl-β-L-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-on [German] [ACD/IUPAC Name]
9-[(2ξ)-2-O-Methyl-β-L-threo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one [ACD/IUPAC Name]
9-[(2ξ)-2-O-Méthyl-β-L-thréo-pentofuranosyl]-1,9-dihydro-6H-purin-6-one [French] [ACD/IUPAC Name]
2'-O-Methylinosine [ACD/IUPAC Name]
3881-21-8 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 724.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.0±3.0 kJ/mol
Flash Point: 391.8±32.9 °C
Index of Refraction: 1.774
Molar Refractivity: 63.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.96
ACD/LogD (pH 5.5): -1.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.75
ACD/LogD (pH 7.4): -1.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.60
Polar Surface Area: 118 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 78.6±7.0 dyne/cm
Molar Volume: 153.1±7.0 cm3

Click to predict properties on the Chemicalize site


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