ChemSpider 2D Image | 2-[(2-Imino-6-oxo-1,2,3,6-tetrahydro-9H-purin-9-yl)methoxy]ethyl D-isoleucinate | C14H22N6O4

2-[(2-Imino-6-oxo-1,2,3,6-tetrahydro-9H-purin-9-yl)methoxy]ethyl D-isoleucinate

  • Molecular FormulaC14H22N6O4
  • Average mass338.362 Da
  • Monoisotopic mass338.170258 Da
  • ChemSpider ID68026227

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

2-[(2-Imino-6-oxo-1,2,3,6-tetrahydro-9H-purin-9-yl)methoxy]ethyl D-isoleucinate [ACD/IUPAC Name]
2-[(2-Imino-6-oxo-1,2,3,6-tetrahydro-9H-purin-9-yl)methoxy]ethyl-D-isoleucinat [German] [ACD/IUPAC Name]
D-Isoleucinate de 2-[(2-imino-6-oxo-1,2,3,6-tétrahydro-9H-purin-9-yl)méthoxy]éthyle [French] [ACD/IUPAC Name]
D-Isoleucine, 2-[(1,2,3,6-tetrahydro-2-imino-6-oxo-9H-purin-9-yl)methoxy]ethyl ester [ACD/Index Name]
Acyclovir L-isoleucinate

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.659
Molar Refractivity: 83.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: -1.91
ACD/LogD (pH 5.5): -3.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.69
Polar Surface Area: 144 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 60.3±7.0 dyne/cm
Molar Volume: 225.3±7.0 cm3

Click to predict properties on the Chemicalize site


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