ChemSpider 2D Image | 2-Hydroxyphenyl hydrogen sulfite | C6H6O4S

2-Hydroxyphenyl hydrogen sulfite

  • Molecular FormulaC6H6O4S
  • Average mass174.174 Da
  • Monoisotopic mass173.998672 Da
  • ChemSpider ID64885546

More details:

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

1,2-Benzenediol, mono(hydrogen sulfite) [ACD/Index Name]
2-Hydroxyphenyl hydrogen sulfite [ACD/IUPAC Name]
2-Hydroxyphenylhydrogensulfit [German] [ACD/IUPAC Name]
Hydrogénosulfite de 2-hydroxyphényle [French] [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: 391.5±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.6±3.0 kJ/mol
Flash Point: 190.5±28.4 °C
Index of Refraction: 1.723
Molar Refractivity: 40.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.20
ACD/LogD (pH 5.5): -3.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 86 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 103.9±3.0 dyne/cm
Molar Volume: 102.4±3.0 cm3

Click to predict properties on the Chemicalize site


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