ChemSpider 2D Image | 5-[(E)-2-Bromovinyl]-1-{(5R)-2-[(C~5~-~3~H_1_)deoxy]-beta-D-threo-pentofuranosyl}-2,4(1H,3H)-pyrimidinedione | C11H12TBrN2O5

5-[(E)-2-Bromovinyl]-1-{(5R)-2-[(C5-3H1)deoxy]-β-D-threo-pentofuranosyl}-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC11H12TBrN2O5
  • Average mass335.143 Da
  • Monoisotopic mass334.009003 Da
  • ChemSpider ID114394354

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

2,4(1H,3H)-Pyrimidinedione, 5-[(E)-2-bromoethenyl]-1-[(5R)-2-(deoxy-C5-t)-β-D-threo-pentofuranosyl]- [ACD/Index Name]
5-[(E)-2-Bromovinyl]-1-{(5R)-2-[(C5-3H1)deoxy]-β-D-threo-pentofuranosyl}-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
5-[(E)-2-Bromovinyl]-1-{(5R)-2-[(C5-3H1)désoxy]-β-D-thréo-pentofuranosyl}-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
5-[(E)-2-Bromvinyl]-1-{(5R)-2-[(C5-3H1)desoxy]-β-D-threo-pentofuranosyl}-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.80
ACD/LogD (pH 5.5): 0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 24.08
ACD/LogD (pH 7.4): -0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 21.59
Polar Surface Area: 99 Å2
Polarizability:
Surface Tension:
Molar Volume:

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