ChemSpider 2D Image | 2,4-Dihydroxybenzenesulfenic Acid | C6H6O3S

2,4-Dihydroxybenzenesulfenic Acid

  • Molecular FormulaC6H6O3S
  • Average mass158.175 Da
  • Monoisotopic mass158.003769 Da
  • ChemSpider ID25057725

More details:

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

2,4-Dihydroxybenzenesulfenic Acid
4-(Hydroxysulfanyl)-1,3-benzenediol [ACD/IUPAC Name]
4-(Hydroxysulfanyl)-1,3-benzènediol [French] [ACD/IUPAC Name]
4-(Hydroxysulfanyl)-1,3-benzoldiol [German] [ACD/IUPAC Name]
Benzenesulfenic acid, 2,4-dihydroxy- [ACD/Index Name]
TH7

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

Density: 1.6±0.1 g/cm3
Boiling Point: 419.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.9±3.0 kJ/mol
Flash Point: 203.6±25.5 °C
Index of Refraction: 1.757
Molar Refractivity: 39.4±0.4 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.71
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.84
ACD/KOC (pH 5.5): 53.93
ACD/LogD (pH 7.4): 0.63
ACD/BCF (pH 7.4): 1.76
ACD/KOC (pH 7.4): 51.42
Polar Surface Area: 86 Å2
Polarizability: 15.6±0.5 10-24cm3
Surface Tension: 100.3±5.0 dyne/cm
Molar Volume: 95.9±5.0 cm3

Click to predict properties on the Chemicalize site


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