ChemSpider 2D Image | 5-carboxyamino-1-(5-phospho-D-ribosyl)imidazole | C9H14N3O9P

5-carboxyamino-1-(5-phospho-D-ribosyl)imidazole

  • Molecular FormulaC9H14N3O9P
  • Average mass339.196 Da
  • Monoisotopic mass339.046753 Da
  • ChemSpider ID21865490

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1H-Imidazol-5-amine, N-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)- [ACD/Index Name]
5-carboxyamino-1-(5-phospho-D-ribosyl)imidazole
N-Carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-imidazol-5-amin [German] [ACD/IUPAC Name]
N-Carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-imidazol-5-amine [ACD/IUPAC Name]
N-Carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-imidazol-5-amine [French] [ACD/IUPAC Name]
  • Miscellaneous

    • Chemical Class:

      A 1-(phosphoribosyl)imidazole having the phospho group at the 5'-position and a carboxyamino group at the 5-position on the imidazole ring. ChEBI CHEBI:48000

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

Density: 2.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.772
Molar Refractivity: 64.6±0.5 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -0.33
ACD/LogD (pH 5.5): -5.71
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 193 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 122.5±7.0 dyne/cm
Molar Volume: 155.2±7.0 cm3

Click to predict properties on the Chemicalize site


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