ChemSpider 2D Image | 4,6-Dihydroxy-5-nitroisophthalaldehyde | C8H5NO6

4,6-Dihydroxy-5-nitroisophthalaldehyde

  • Molecular FormulaC8H5NO6
  • Average mass211.128 Da
  • Monoisotopic mass211.011688 Da
  • ChemSpider ID74118419

More details:

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

1,3-Benzenedicarboxaldehyde, 4,6-dihydroxy-5-nitro- [ACD/Index Name]
4,6-Dihydroxy-5-nitroisophtalaldéhyde [French] [ACD/IUPAC Name]
4,6-Dihydroxy-5-nitroisophthalaldehyd [German] [ACD/IUPAC Name]
4,6-Dihydroxy-5-nitroisophthalaldehyde [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 250.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.8±3.0 kJ/mol
Flash Point: 105.9±15.8 °C
Index of Refraction: 1.762
Molar Refractivity: 50.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 120 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 98.7±3.0 dyne/cm
Molar Volume: 121.5±3.0 cm3

Click to predict properties on the Chemicalize site


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