ChemSpider 2D Image | 1,5-Anhydro-2-[(cyclohexylcarbonyl)amino]-2,6-dideoxy-6-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-D-altritol | C20H29N5O6

1,5-Anhydro-2-[(cyclohexylcarbonyl)amino]-2,6-dideoxy-6-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-D-altritol

  • Molecular FormulaC20H29N5O6
  • Average mass435.474 Da
  • Monoisotopic mass435.211792 Da
  • ChemSpider ID80832552

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1,5-Anhydro-2-[(cyclohexylcarbonyl)amino]-2,6-dideoxy-6-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-D-altritol [ACD/IUPAC Name]
1,5-Anhydro-2-[(cyclohexylcarbonyl)amino]-2,6-didesoxy-6-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-D-altritol [German] [ACD/IUPAC Name]
1,5-Anhydro-2-[(cyclohexylcarbonyl)amino]-2,6-didésoxy-6-(1,3-diméthyl-2,6-dioxo-1,2,3,6-tétrahydro-9H-purin-9-yl)-D-altritol [French] [ACD/IUPAC Name]
D-Altritol, 1,5-anhydro-2-[(cyclohexylcarbonyl)amino]-2,6-dideoxy-6-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-9H-purin-9-yl)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.719
Molar Refractivity: 107.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 0.19
ACD/LogD (pH 5.5): 0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 29.10
ACD/LogD (pH 7.4): 0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.10
Polar Surface Area: 137 Å2
Polarizability: 42.7±0.5 10-24cm3
Surface Tension: 67.0±7.0 dyne/cm
Molar Volume: 273.2±7.0 cm3

Click to predict properties on the Chemicalize site


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