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Search term: BOZIPIJJVGFENR (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-[(6-Ethyl-1-oxido-5,7-dioxo-6,7-dihydro[1,2,5]oxadiazolo[3,4-d]pyrimidin-4(5H)-yl)methoxy]-1,3-propanediyl diacetate | C14H18N4O9

2-[(6-Ethyl-1-oxido-5,7-dioxo-6,7-dihydro[1,2,5]oxadiazolo[3,4-d]pyrimidin-4(5H)-yl)methoxy]-1,3-propanediyl diacetate

  • Molecular FormulaC14H18N4O9
  • Average mass386.314 Da
  • Monoisotopic mass386.107391 Da
  • ChemSpider ID58128908

More details:

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

[1,2,5]Oxadiazolo[3,4-d]pyrimidine-5,7(4H,6H)-dione, 4-[[2-(acetyloxy)-1-[(acetyloxy)methyl]ethoxy]methyl]-6-ethyl-, 1-oxide [ACD/Index Name]
2-[(6-Ethyl-1-oxido-5,7-dioxo-6,7-dihydro[1,2,5]oxadiazolo[3,4-d]pyrimidin-4(5H)-yl)methoxy]-1,3-propandiyl-diacetat [German] [ACD/IUPAC Name]
2-[(6-Ethyl-1-oxido-5,7-dioxo-6,7-dihydro[1,2,5]oxadiazolo[3,4-d]pyrimidin-4(5H)-yl)methoxy]-1,3-propanediyl diacetate [ACD/IUPAC Name]
Diacétate de 2-[(6-éthyl-5,7-dioxo-1-oxydo-6,7-dihydro[1,2,5]oxadiazolo[3,4-d]pyrimidin-4(5H)-yl)méthoxy]-1,3-propanediyle [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 549.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.9±3.0 kJ/mol
Flash Point: 286.0±32.9 °C
Index of Refraction: 1.612
Molar Refractivity: 86.2±0.5 cm3
#H bond acceptors: 13
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: -0.48
ACD/LogD (pH 5.5): 0.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 24.74
ACD/LogD (pH 7.4): 0.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 24.74
Polar Surface Area: 154 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 60.1±7.0 dyne/cm
Molar Volume: 247.8±7.0 cm3

Click to predict properties on the Chemicalize site


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