ChemSpider 2D Image | 5-[(E)-2-Bromovinyl]-1-[5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-beta-D-arabinofuranosyl]-2,4(1H,3H)-pyrimidinedione | C11H16BrN2O15P3

5-[(E)-2-Bromovinyl]-1-[5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-arabinofuranosyl]-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC11H16BrN2O15P3
  • Average mass589.074 Da
  • Monoisotopic mass587.894653 Da
  • ChemSpider ID4437955

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2,4(1H,3H)-Pyrimidinedione, 5-[(E)-2-bromoethenyl]-1-[5-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-β-D-arabinofuranosyl]- [ACD/Index Name]
5-[(E)-2-Bromovinyl]-1-[5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-arabinofuranosyl]-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
5-[(E)-2-Bromovinyl]-1-[5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-arabinofuranosyl]-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
5-[(E)-2-Bromvinyl]-1-[5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-β-D-arabinofuranosyl]-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 5-(2-bromoethenyl)-1-(5-O-(hydroxy((hydroxy(phosphonooxy)phosphinyl)oxy)phosphinyl)-β-D-arabinofuranosyl)-, (E)-
2,4(1H,3H)-Pyrimidinedione, 5-[(E)-2-bromoethenyl]-1-[5-O-[hydroxy[[hydroxy(phosphonooxy)phosphinyl]oxy]phosphinyl]-β-D-arabinofuranosyl]-
5-(2-Bromovinyl)-1-arabinofuranosyluracil 5'-triphosphate
79551-90-9 [RN]
Brvarafutp
BVaraUTP

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

AIDS224468 [DBID]
AIDS-224468 [DBID]

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

Density: 2.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.713
Molar Refractivity: 102.0±0.3 cm3
#H bond acceptors: 17
#H bond donors: 7
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -4.64
ACD/LogD (pH 5.5): -11.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -11.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 288 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 136.6±3.0 dyne/cm
Molar Volume: 260.4±3.0 cm3

Click to predict properties on the Chemicalize site


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