ChemSpider 2D Image | 4-Amino-1-[(3xi)-5-O-(~13~C_5_)phosphono-beta-D-threo-pentofuranosyl]-2(1H)-pyrimidinone | C413C5H14N3O8P

4-Amino-1-[(3ξ)-5-O-(13C5)phosphono-β-D-threo-pentofuranosyl]-2(1H)-pyrimidinone

  • Molecular FormulaC413C5H14N3O8P
  • Average mass328.160 Da
  • Monoisotopic mass328.068634 Da
  • ChemSpider ID58781514

  • defined stereocentres - 3 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

2(1H)-Pyrimidinone, 4-amino-1-[(3ξ)-5-O-(phosphono-13C5)-β-D-threo-pentofuranosyl]- [ACD/Index Name]
4-Amino-1-[(3ξ)-5-O-(13C5)phosphono-β-D-threo-pentofuranosyl]-2(1H)-pyrimidinon [German] [ACD/IUPAC Name]
4-Amino-1-[(3ξ)-5-O-(13C5)phosphono-β-D-threo-pentofuranosyl]-2(1H)-pyrimidinone [ACD/IUPAC Name]
4-Amino-1-[(3ξ)-5-O-(13C5)phosphono-β-D-thréo-pentofuranosyl]-2(1H)-pyrimidinone [French] [ACD/IUPAC Name]

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: 1.775
Molar Refractivity: 62.6±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 121.6±7.0 dyne/cm
Molar Volume: 150.0±7.0 cm3

Click to predict properties on the Chemicalize site


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