ChemSpider 2D Image | 3-Carbamoyl-1-[(4xi)-5-O-phosphonato-D-erythro-pentofuranosyl]pyridinium | C11H14N2O8P

3-Carbamoyl-1-[(4ξ)-5-O-phosphonato-D-erythro-pentofuranosyl]pyridinium

  • Molecular FormulaC11H14N2O8P
  • Average mass333.212 Da
  • Monoisotopic mass333.049316 Da
  • ChemSpider ID23104499

  • Charge - Charge

    defined stereocentres - 2 of 4 defined stereocentres

More details:

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

3-Carbamoyl-1-[(4ξ)-5-O-phosphonato-D-erythro-pentofuranosyl]pyridinium [ACD/IUPAC Name]
3-Carbamoyl-1-[(4ξ)-5-O-phosphonato-D-erythro-pentofuranosyl]pyridinium [German] [ACD/IUPAC Name]
3-Carbamoyl-1-[(4ξ)-5-O-phosphonato-D-érythro-pentofuranosyl]pyridinium [French] [ACD/IUPAC Name]
Pyridinium, 3-(aminocarbonyl)-1-[(4ξ)-5-O-phosphono-D-erythro-pentofuranosyl]-, inner salt, ion(1-) [ACD/Index Name]
β-Nicotinamide mononucleotide

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -3.38
ACD/LogD (pH 5.5): -3.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 179 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement