Found 1 result

Search term: MF = 'C_{26}H_{23}N_{5}O_{12}P_{2}'
ChemSpider 2D Image | 3-{5-O-[({[(4-Benzoylbenzoyl)oxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]-beta-D-ribofuranosyl}-3H-imidazo[2,1-i]purine | C26H23N5O12P2

3-{5-O-[({[(4-Benzoylbenzoyl)oxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]-β-D-ribofuranosyl}-3H-imidazo[2,1-i]purine

  • Molecular FormulaC26H23N5O12P2
  • Average mass659.435 Da
  • Monoisotopic mass659.081848 Da
  • ChemSpider ID2339981

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

3-{5-O-[({[(4-Benzoylbenzoyl)oxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]-β-D-ribofuranosyl}-3H-imidazo[2,1-i]purin [German] [ACD/IUPAC Name]
3-{5-O-[({[(4-Benzoylbenzoyl)oxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]-β-D-ribofuranosyl}-3H-imidazo[2,1-i]purine [ACD/IUPAC Name]
3-{5-O-[({[(4-Benzoylbenzoyl)oxy](hydroxy)phosphoryl}oxy)(hydroxy)phosphoryl]-β-D-ribofuranosyl}-3H-imidazo[2,1-i]purine [French] [ACD/IUPAC Name]
3H-Imidazo[2,1-i]purine, 3-[5-O-[[[[(4-benzoylbenzoyl)oxy]hydroxyphosphinyl]oxy]hydroxyphosphinyl]-β-D-ribofuranosyl]- [ACD/Index Name]
110682-84-3 [RN]
3'(2')-O-(4-Benzoylbenzoyl)-1,N(6)-ethenoadenosine 5'-diphosphate
3H-Imidazo(2,1-i)purine, 3-(2(or 3)-O-(4-benzoylbenzoyl)-5-O-(hydroxy(phosphonooxy)phosphinyl)-β-D-ribofuranosyl)-
Bz(2)ε ADP

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.775
Molar Refractivity: 150.2±0.5 cm3
#H bond acceptors: 17
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: -0.13
ACD/LogD (pH 5.5): -5.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 254 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 95.1±7.0 dyne/cm
Molar Volume: 359.8±7.0 cm3

Click to predict properties on the Chemicalize site


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