ChemSpider 2D Image | 6-Benzyl-1-(ethoxymethyl)-5-[(1,1,1,3,3,3-~2~H_6_)-2-propanyl]-2,4(1H,3H)-pyrimidinedione | C17H16D6N2O3

6-Benzyl-1-(ethoxymethyl)-5-[(1,1,1,3,3,3-2H6)-2-propanyl]-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC17H16D6N2O3
  • Average mass308.405 Da
  • Monoisotopic mass308.200714 Da
  • ChemSpider ID114810653

  • Non-standard isotope - Non-standard isotope

More details:

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

2,4(1H,3H)-Pyrimidinedione, 1-(ethoxymethyl)-5-[1-(methyl-d3)ethyl-2,2,2-d3]-6-(phenylmethyl)- [ACD/Index Name]
6-Benzyl-1-(ethoxymethyl)-5-[(1,1,1,3,3,3-2H6)-2-propanyl]-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
6-Benzyl-1-(ethoxymethyl)-5-[(1,1,1,3,3,3-2H6)-2-propanyl]-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
6-Benzyl-1-(éthoxyméthyl)-5-[(1,1,1,3,3,3-2H6)-2-propanyl]-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.542
Molar Refractivity: 84.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.18
ACD/LogD (pH 5.5): 2.74
ACD/BCF (pH 5.5): 70.86
ACD/KOC (pH 5.5): 734.71
ACD/LogD (pH 7.4): 2.73
ACD/BCF (pH 7.4): 70.26
ACD/KOC (pH 7.4): 728.51
Polar Surface Area: 59 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 266.7±3.0 cm3

Click to predict properties on the Chemicalize site


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