ChemSpider 2D Image | 1,5-Anhydro-2,3,4-trideoxy-4-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-1-phosphonohex-1-enitol | C11H15N2O7P

1,5-Anhydro-2,3,4-trideoxy-4-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-1-phosphonohex-1-enitol

  • Molecular FormulaC11H15N2O7P
  • Average mass318.220 Da
  • Monoisotopic mass318.061676 Da
  • ChemSpider ID23123994

More details:

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

1,5-Anhydro-2,3,4-trideoxy-4-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-1-phosphonohex-1-enitol [ACD/IUPAC Name]
1,5-anhydro-2,3,4-trideoxy-4-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-1-phosphonohex-1-enitol
1,5-Anhydro-2,3,4-tridesoxy-4-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-1-phosphonohex-1-enitol [German] [ACD/IUPAC Name]
1,5-Anhydro-2,3,4-tridésoxy-4-(5-méthyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-1-phosphonohex-1-énitol [French] [ACD/IUPAC Name]
Hex-1-enitol, 1,5-anhydro-2,3,4-trideoxy-4-(3,4-dihydro-5-methyl-2,4-dioxo-1(2H)-pyrimidinyl)-1-C-phosphono- [ACD/Index Name]
[6-Hydroxymethyl-5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-5,6-dihydro-4H-pyran-2-yl]-phosphonic acid
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL434968/

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.634
Molar Refractivity: 69.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.85
ACD/LogD (pH 5.5): -6.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 146 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 82.9±5.0 dyne/cm
Molar Volume: 193.2±5.0 cm3

Click to predict properties on the Chemicalize site


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