ChemSpider 2D Image | (6R)-4-C-Acetyl-3-(3-acetyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-1-deoxy-6-(hydroxymethyl)-beta-D-erythro-hexo-2,3-diulo-3,6-furanosyl | C15H18N2O9

(6R)-4-C-Acetyl-3-(3-acetyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-1-deoxy-6-(hydroxymethyl)-β-D-erythro-hexo-2,3-diulo-3,6-furanosyl

  • Molecular FormulaC15H18N2O9
  • Average mass370.311 Da
  • Monoisotopic mass370.101227 Da
  • ChemSpider ID24746141

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(6R)-4-C-Acetyl-3-(3-acetyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-1-deoxy-6-(hydroxymethyl)-β-D-erythro-hexo-2,3-diulo-3,6-furanosyl [ACD/IUPAC Name]
(6R)-4-C-Acetyl-3-(3-acetyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-1-desoxy-6-(hydroxymethyl)-β-D-erythro-hexo-2,3-diulo-3,6-furanosyl [German] [ACD/IUPAC Name]
(6R)-4-C-Acétyl-3-(3-acétyl-2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-1-désoxy-6-(hydroxyméthyl)-β-D-érythro-hexo-2,3-diulo-3,6-furanosyl [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 3-acetyl-1-(4-C-acetyl-1-deoxy-β-D-ribo-2,3-heptodiulo-3,6-furanosyl)- [ACD/Index Name]
4105-38-8 [RN]
Triacetyluridine

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

Density: 1.6±0.1 g/cm3
Boiling Point: 622.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 105.8±6.0 kJ/mol
Flash Point: 330.4±34.3 °C
Index of Refraction: 1.611
Molar Refractivity: 80.4±0.3 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 0.56
ACD/LogD (pH 5.5): -0.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.18
ACD/LogD (pH 7.4): -0.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.18
Polar Surface Area: 162 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 82.7±3.0 dyne/cm
Molar Volume: 231.4±3.0 cm3

Click to predict properties on the Chemicalize site


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