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Search term: PDACUKOKVHBVHJ-ZRTZXPPTSA-M (Found by InChIKey (full match))

ChemSpider 2D Image | 5-Amino-1-(5-O-phosphonato-D-ribofuranosyl)-1H-imidazol-3-ium | C8H13N3O7P

5-Amino-1-(5-O-phosphonato-D-ribofuranosyl)-1H-imidazol-3-ium

  • Molecular FormulaC8H13N3O7P
  • Average mass294.179 Da
  • Monoisotopic mass294.049652 Da
  • ChemSpider ID26331261
  • Charge - Charge

    defined stereocentres - 3 of 4 defined stereocentres


More details:






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

1H-Imidazol-5-amine, 1-(5-O-phosphono-D-ribofuranosyl)-, inner salt, ion(1-) [ACD/Index Name]
5-Amino-1-(5-O-phosphonato-D-ribofuranosyl)-1H-imidazol-3-ium [German] [ACD/IUPAC Name]
5-Amino-1-(5-O-phosphonato-D-ribofuranosyl)-1H-imidazol-3-ium [ACD/IUPAC Name]
5-Amino-1-(5-O-phosphonato-D-ribofuranosyl)-1H-imidazol-3-ium [French] [ACD/IUPAC Name]
5-Amino-1-(5-phospho-D-ribosyl)imidazole
5-amino-1-(5-phosphonato-D-ribosyl)imidazol-3-ium

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point: 774.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.2±3.0 kJ/mol
Flash Point: 421.9±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -2.09
ACD/LogD (pH 5.5): -5.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 177 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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