ChemSpider 2D Image | 5-Deoxy-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-1-O-[hydroxy(phosphonooxy)phosphoryl]-D-ribitol | C17H22N4O12P2

5-Deoxy-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-1-O-[hydroxy(phosphonooxy)phosphoryl]-D-ribitol

  • Molecular FormulaC17H22N4O12P2
  • Average mass536.324 Da
  • Monoisotopic mass536.070923 Da
  • ChemSpider ID133921

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

5-Deoxy-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-1-O-[hydroxy(phosphonooxy)phosphoryl]-D-ribitol [ACD/IUPAC Name]
5-Desoxy-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-1-O-[hydroxy(phosphonooxy)phosphoryl]-D-ribitol [German] [ACD/IUPAC Name]
5-Désoxy-5-(7,8-diméthyl-2,4-dioxo-3,4-dihydrobenzo[g]ptéridin-10(2H)-yl)-1-O-[hydroxy(phosphonooxy)phosphoryl]-D-ribitol [French] [ACD/IUPAC Name]
D-Ribitol, 5-deoxy-5-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10(2H)-yl)-1-O-[hydroxy(phosphonooxy)phosphinyl]- [ACD/Index Name]
14985-41-2 [RN]
Riboflavin 5'-(trihydrogen diphosphate)
riboflavin 5/'-pyrophosphate
Riboflavin 5'-pyrophosphate
RIBOFLAVIN 5'-PYROPHOSPHONATE

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.758
Molar Refractivity: 111.0±0.5 cm3
#H bond acceptors: 16
#H bond donors: 7
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -3.44
ACD/LogD (pH 5.5): -8.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 268 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 104.7±7.0 dyne/cm
Molar Volume: 270.2±7.0 cm3

Click to predict properties on the Chemicalize site


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