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Search term: Nc1ncc2ncn([C@H]3C[C@H](O)[C@@H](COP(O)=O)O3)c2n1 (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | 9-{2-deoxy-5-O-[hydroxy(oxido)phosphino]-beta-L-erythro-pentofuranosyl}-9H-purin-2-amine | C10H14N5O5P

9-{2-deoxy-5-O-[hydroxy(oxido)phosphino]-β-L-erythro-pentofuranosyl}-9H-purin-2-amine

  • Molecular FormulaC10H14N5O5P
  • Average mass315.222 Da
  • Monoisotopic mass315.073242 Da
  • ChemSpider ID25057278

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

9-{2-deoxy-5-O-[hydroxy(oxido)phosphino]-β-L-erythro-pentofuranosyl}-9H-purin-2-amine
9-{2-Deoxy-5-O-[hydroxy(oxido)phosphoranyl]-β-D-erythro-pentofuranosyl}-9H-purin-2-amine [ACD/IUPAC Name]
9-{2-Desoxy-5-O-[hydroxy(oxido)phosphoranyl]-β-D-erythro-pentofuranosyl}-9H-purin-2-amin [German] [ACD/IUPAC Name]
9-{2-Désoxy-5-O-[hydroxy(oxydo)phosphoranyl]-β-D-érythro-pentofuranosyl}-9H-purin-2-amine [French] [ACD/IUPAC Name]
9H-Purin-2-amine, 9-[2-deoxy-5-O-(hydroxyphosphinyl)-β-D-erythro-pentofuranosyl]- [ACD/Index Name]

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

Density:
Boiling Point: 728.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.6±3.0 kJ/mol
Flash Point: 394.1±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -4.43
ACD/LogD (pH 5.5): -6.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 169 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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