ChemSpider 2D Image | ({[1-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-3-hydroxy(~2~H_5_)-2-propanyl]oxy}methyl)phosphonic acid | C8H9D5N3O6P

({[1-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-3-hydroxy(2H5)-2-propanyl]oxy}methyl)phosphonic acid

  • Molecular FormulaC8H9D5N3O6P
  • Average mass284.218 Da
  • Monoisotopic mass284.093414 Da
  • ChemSpider ID107435357

  • Non-standard isotope - Non-standard isotope

More details:

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

({[1-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-3-hydroxy(2H5)-2-propanyl]oxy}methyl)phosphonic acid [ACD/IUPAC Name]
({[1-(4-Amino-2-oxo-1(2H)-pyrimidinyl)-3-hydroxy(2H5)-2-propanyl]oxy}methyl)phosphonsäure [German] [ACD/IUPAC Name]
Acide ({[1-(4-amino-2-oxo-1(2H)-pyrimidinyl)-3-hydroxy(2H5)-2-propanyl]oxy}méthyl)phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [[[2-(4-amino-2-oxo-1(2H)-pyrimidinyl)-1-(hydroxymethyl-d2)ethyl-1,2,2-d3]oxy]methyl]- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 609.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.0 mmHg at 25°C
Enthalpy of Vaporization: 103.8±6.0 kJ/mol
Flash Point: 322.4±34.3 °C
Index of Refraction: 1.656
Molar Refractivity: 58.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -3.37
ACD/LogD (pH 5.5): -6.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 155 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 90.6±7.0 dyne/cm
Molar Volume: 158.6±7.0 cm3

Click to predict properties on the Chemicalize site


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