ChemSpider 2D Image | 5-(~2~H_5_)Ethyl-5-(2-pentanyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione | C11H13D5N2O2S

5-(2H5)Ethyl-5-(2-pentanyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

  • Molecular FormulaC11H13D5N2O2S
  • Average mass247.369 Da
  • Monoisotopic mass247.140289 Da
  • ChemSpider ID58785080
  • Non-standard isotope - Non-standard isotope


More details:






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

4,6(1H,5H)-Pyrimidinedione, 5-(ethyl-d5)dihydro-5-(1-methylbutyl)-2-thioxo- [ACD/Index Name]
5-(2H5)Ethyl-5-(2-pentanyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidindion [German] [ACD/IUPAC Name]
5-(2H5)Ethyl-5-(2-pentanyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione [ACD/IUPAC Name]
5-(2H5)Éthyl-5-(2-pentanyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione [French] [ACD/IUPAC Name]
1189485-63-9 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.544
Molar Refractivity: 65.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.99
ACD/LogD (pH 5.5): 2.93
ACD/BCF (pH 5.5): 98.38
ACD/KOC (pH 5.5): 922.98
ACD/LogD (pH 7.4): 2.48
ACD/BCF (pH 7.4): 34.81
ACD/KOC (pH 7.4): 326.58
Polar Surface Area: 90 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 48.9±5.0 dyne/cm
Molar Volume: 207.6±5.0 cm3

Click to predict properties on the Chemicalize site






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