ChemSpider 2D Image | 4-Nitro-1,2,3,5-benzenetetrol | C6H5NO6

4-Nitro-1,2,3,5-benzenetetrol

  • Molecular FormulaC6H5NO6
  • Average mass187.107 Da
  • Monoisotopic mass187.011688 Da
  • ChemSpider ID60847835

More details:

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

1,2,3,5-Benzenetetrol, 4-nitro- [ACD/Index Name]
4-Nitro-1,2,3,5-benzenetetrol [ACD/IUPAC Name]
4-Nitro-1,2,3,5-benzènetétrol [French] [ACD/IUPAC Name]
4-Nitro-1,2,3,5-benzoltetrol [German] [ACD/IUPAC Name]
1394920-08-1 [RN]
MFCD23111347

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

Density: 2.0±0.1 g/cm3
Boiling Point: 374.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.6±3.0 kJ/mol
Flash Point: 173.1±16.3 °C
Index of Refraction: 1.792
Molar Refractivity: 40.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.28
ACD/LogD (pH 5.5): 0.62
ACD/BCF (pH 5.5): 1.31
ACD/KOC (pH 5.5): 29.99
ACD/LogD (pH 7.4): -1.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 127 Å2
Polarizability: 16.0±0.5 10-24cm3
Surface Tension: 133.3±3.0 dyne/cm
Molar Volume: 95.0±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement