ChemSpider 2D Image | 1,2-Diallyl 3-{[5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2,5-dihydro-2-furanyl]methyl} citrate | C22H26N2O10

1,2-Diallyl 3-{[5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2,5-dihydro-2-furanyl]methyl} citrate

  • Molecular FormulaC22H26N2O10
  • Average mass478.449 Da
  • Monoisotopic mass478.158752 Da
  • ChemSpider ID20019158

More details:

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

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, 1-[[5-(3,4-dihydro-5-methyl-2,4-dioxo-1(2H)-pyrimidinyl)-2,5-dihydro-2-furanyl]methyl] 2,3-di-2-propen-1-yl ester [ACD/Index Name]
1,2-Diallyl 3-{[5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2,5-dihydro-2-furanyl]methyl} citrate [ACD/IUPAC Name]
1,2-Diallyl 3-{[5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2,5-dihydrofuran-2-yl]methyl} 2-hydroxypropane-1,2,3-tricarboxylate
1,2-Diallyl-3-{[5-(5-methyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2,5-dihydro-2-furanyl]methyl}citrat [German] [ACD/IUPAC Name]
1-{[5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2,5-dihydrofuran-2-yl]methyl} 2,3-diprop-2-en-1-yl 2-hydroxypropane-1,2,3-tricarboxylate
Citrate de 1,2-diallyle et de 3-{[5-(5-méthyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2,5-dihydro-2-furanyl]méthyle} [French] [ACD/IUPAC Name]
3-Allyloxycarbonyl-3-hydroxy-pentanedioic acid allyl ester 5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-2,5-dihydro-furan-2-ylmethyl ester

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.544
Molar Refractivity: 114.2±0.3 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 0.89
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 3.06
ACD/KOC (pH 5.5): 77.53
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 3.04
ACD/KOC (pH 7.4): 76.89
Polar Surface Area: 158 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 52.3±3.0 dyne/cm
Molar Volume: 361.9±3.0 cm3

Click to predict properties on the Chemicalize site


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