ChemSpider 2D Image | 1-(3-O-Phosphono-beta-D-threo-pent-4-enofuranosyl)-2,4(1H,3H)-pyrimidinedione | C9H11N2O9P

1-(3-O-Phosphono-β-D-threo-pent-4-enofuranosyl)-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC9H11N2O9P
  • Average mass322.165 Da
  • Monoisotopic mass322.020203 Da
  • ChemSpider ID61716061

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1-(3-O-Phosphono-β-D-threo-pent-4-enofuranosyl)-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-(3-O-Phosphono-β-D-threo-pent-4-enofuranosyl)-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-(3-O-Phosphono-β-D-thréo-pent-4-énofuranosyl)-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
1-[(4E)-3-O-Phosphono-β-D-threo-pent-4-enofuranosyl]-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-[(4E)-3-O-Phosphono-β-D-threo-pent-4-enofuranosyl]-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-[(4E)-3-O-Phosphono-β-D-thréo-pent-4-énofuranosyl]-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-(3-O-phosphono-β-D-threo-pent-4-enofuranosyl)- [ACD/Index Name]
2,4(1H,3H)-Pyrimidinedione, 1-[(4E)-3-O-phosphono-β-D-threo-pent-4-enofuranosyl]- [ACD/Index Name]
UA3
URACIL ARABINOSE-3'-PHOSPHATE

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.693
Molar Refractivity: 63.3±0.4 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -2.60
ACD/LogD (pH 5.5): -6.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 176 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 116.3±5.0 dyne/cm
Molar Volume: 165.0±5.0 cm3

Click to predict properties on the Chemicalize site


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