ChemSpider 2D Image | Clitidine 5'-phosphate | C11H15N2O9P

Clitidine 5'-phosphate

  • Molecular FormulaC11H15N2O9P
  • Average mass350.219 Da
  • Monoisotopic mass350.051514 Da
  • ChemSpider ID30791235

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1,4-Dihydro-4-imino-1-(5-O-phosphono-β-D-ribofuranosyl)-3-pyridinecarboxylic acid
3-Pyridinecarboxylic acid, 1,4-dihydro-4-imino-1-(5-O-phosphono-β-D-ribofuranosyl)- [ACD/Index Name]
4-Imino-1-(5-O-phosphono-β-D-ribofuranosyl)-1,4-dihydro-3-pyridincarbonsäure [German] [ACD/IUPAC Name]
4-Imino-1-(5-O-phosphono-β-D-ribofuranosyl)-1,4-dihydro-3-pyridinecarboxylic acid [ACD/IUPAC Name]
65411-71-4 [RN]
Acide 4-imino-1-(5-O-phosphono-β-D-ribofuranosyl)-1,4-dihydro-3-pyridinecarboxylique [French] [ACD/IUPAC Name]
Clitidine 5'-phosphate

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

Density: 2.0±0.1 g/cm3
Boiling Point: 676.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.6±6.0 kJ/mol
Flash Point: 362.9±34.3 °C
Index of Refraction: 1.728
Molar Refractivity: 69.6±0.5 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -2.36
ACD/LogD (pH 5.5): -6.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 191 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 106.4±7.0 dyne/cm
Molar Volume: 174.7±7.0 cm3

Click to predict properties on the Chemicalize site


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