ChemSpider 2D Image | 1-[2-Acetamido-2-deoxy-4-(hydroxymethyl)-5-methyl-alpha-L-lyxofuranosyluronosyl]-5-methyl-2,4(1H,3H)-pyrimidinedione | C14H19N3O8

1-[2-Acetamido-2-deoxy-4-(hydroxymethyl)-5-methyl-α-L-lyxofuranosyluronosyl]-5-methyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC14H19N3O8
  • Average mass357.316 Da
  • Monoisotopic mass357.117218 Da
  • ChemSpider ID29323750

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1-[2-Acetamido-2-deoxy-4-(hydroxymethyl)-5-methyl-α-L-lyxofuranosyluronosyl]-5-methyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-[2-Acetamido-2-desoxy-4-(hydroxymethyl)-5-methyl-α-L-lyxofuranosyluronosyl]-5-methyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-[2-Acétamido-2-désoxy-4-(hydroxyméthyl)-5-méthyl-α-L-lyxofuranosyluronosyl]-5-méthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[2-(acetylamino)-2-deoxy-4-C-(hydroxymethyl)-5-methyl-α-L-lyxofuranuronosyl]-5-methyl- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 80.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.63
ACD/LogD (pH 5.5): -1.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.14
ACD/LogD (pH 7.4): -1.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.10
Polar Surface Area: 155 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 72.8±5.0 dyne/cm
Molar Volume: 234.2±5.0 cm3

Click to predict properties on the Chemicalize site


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