ChemSpider 2D Image | ZINC71613882 | C14H17N5O8

ZINC71613882

  • Molecular FormulaC14H17N5O8
  • Average mass383.314 Da
  • Monoisotopic mass383.107727 Da
  • ChemSpider ID64870944

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

9-[2,3-Bis-C-(carboxymethyl)-β-L-arabinofuranosyl]-9H-purin-6-amin [German] [ACD/IUPAC Name]
9-[2,3-Bis-C-(carboxymethyl)-β-L-arabinofuranosyl]-9H-purin-6-amine [ACD/IUPAC Name]
9-[2,3-Bis-C-(carboxyméthyl)-β-L-arabinofuranosyl]-9H-purin-6-amine [French] [ACD/IUPAC Name]
9H-Purin-6-amine, 9-[2,3-bis-C-(carboxymethyl)-β-L-arabinofuranosyl]- [ACD/Index Name]
ZINC71613882

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

Density: 2.0±0.1 g/cm3
Boiling Point: 888.4±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 135.3±3.0 kJ/mol
Flash Point: 491.1±37.1 °C
Index of Refraction: 1.809
Molar Refractivity: 82.9±0.5 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 1.23
ACD/LogD (pH 5.5): -1.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 214 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 107.9±7.0 dyne/cm
Molar Volume: 192.3±7.0 cm3

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