ChemSpider 2D Image | S-(2,4-dihydroxyphenyl) hydrogen thiocarbonate | C7H6O4S

S-(2,4-dihydroxyphenyl) hydrogen thiocarbonate

  • Molecular FormulaC7H6O4S
  • Average mass186.185 Da
  • Monoisotopic mass185.998672 Da
  • ChemSpider ID22378158

More details:






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

S-(2,4-dihydroxyphenyl) hydrogen thiocarbonate
S24

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 464.4±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.5±3.0 kJ/mol
Flash Point: 234.7±26.8 °C
Index of Refraction: 1.738
Molar Refractivity: 44.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.33
ACD/LogD (pH 5.5): -2.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 103 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 102.5±5.0 dyne/cm
Molar Volume: 109.6±5.0 cm3

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