ChemSpider 2D Image | 5-[2-(2-Amino-9H-purin-9-yl)ethyl]-1,3,2-dioxaphosphinan-2-ol 2-oxide | C10H14N5O4P

5-[2-(2-Amino-9H-purin-9-yl)ethyl]-1,3,2-dioxaphosphinan-2-ol 2-oxide

  • Molecular FormulaC10H14N5O4P
  • Average mass299.223 Da
  • Monoisotopic mass299.078339 Da
  • ChemSpider ID23143635

More details:

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

2-Oxyde de 5-[2-(2-amino-9H-purin-9-yl)éthyl]-1,3,2-dioxaphosphinan-2-ol [French] [ACD/IUPAC Name]
5-[2-(2-Amino-9H-purin-9-yl)ethyl]-1,3,2-dioxaphosphinan-2-ol 2-oxide [ACD/IUPAC Name]
5-[2-(2-Amino-9H-purin-9-yl)ethyl]-1,3,2-dioxaphosphinan-2-ol-2-oxid [German] [ACD/IUPAC Name]
9H-Purin-2-amine, 9-[2-(2-hydroxy-2-oxido-1,3,2-dioxaphosphorinan-5-yl)ethyl]- [ACD/Index Name]
5-[2-(2-Amino-purin-9-yl)-ethyl]-2-oxo-2λ*5*-[1,3,2]dioxaphosphinan-2-ol
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL298880/

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

Density: 1.9±0.1 g/cm3
Boiling Point: 590.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.6±3.0 kJ/mol
Flash Point: 310.8±32.9 °C
Index of Refraction: 1.798
Molar Refractivity: 67.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 3
#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: 135 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 99.6±7.0 dyne/cm
Molar Volume: 157.8±7.0 cm3

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