ChemSpider 2D Image | 1-{7,8-Bis[(~2~H_3_)methyl]-2,4-dioxo(6,9-~2~H_2_)-3,4-dihydrobenzo[g]pteridin-10(2H)-yl}-1-deoxy-D-ribitol | C17H12D8N4O6

1-{7,8-Bis[(2H3)methyl]-2,4-dioxo(6,9-2H2)-3,4-dihydrobenzo[g]pteridin-10(2H)-yl}-1-deoxy-D-ribitol

  • Molecular FormulaC17H12D8N4O6
  • Average mass384.413 Da
  • Monoisotopic mass384.188507 Da
  • ChemSpider ID60958603

  • 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

1-{7,8-Bis[(2H3)methyl]-2,4-dioxo(6,9-2H2)-3,4-dihydrobenzo[g]pteridin-10(2H)-yl}-1-deoxy-D-ribitol [ACD/IUPAC Name]
1-{7,8-Bis[(2H3)methyl]-2,4-dioxo(6,9-2H2)-3,4-dihydrobenzo[g]pteridin-10(2H)-yl}-1-desoxy-D-ribitol [German] [ACD/IUPAC Name]
1-{7,8-Bis[(2H3)méthyl]-2,4-dioxo(6,9-2H2)-3,4-dihydrobenzo[g]ptéridin-10(2H)-yl}-1-désoxy-D-ribitol [French] [ACD/IUPAC Name]
D-Ribitol, 1-deoxy-1-[3,4-dihydro-7,8-di(methyl-d3)-2,4-dioxobenzo[g]pteridin-10(2H)-yl-6,9-d2]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.733
Molar Refractivity: 91.1±0.5 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -2.02
ACD/LogD (pH 5.5): -1.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.72
ACD/LogD (pH 7.4): -1.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.70
Polar Surface Area: 155 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 70.3±7.0 dyne/cm
Molar Volume: 227.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement