ChemSpider 2D Image | 3-Iodo-4-sulfanylphenol | C6H5IOS

3-Iodo-4-sulfanylphenol

  • Molecular FormulaC6H5IOS
  • Average mass252.073 Da
  • Monoisotopic mass251.910568 Da
  • ChemSpider ID60833943

More details:

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

3-Iod-4-sulfanylphenol [German] [ACD/IUPAC Name]
3-Iodo-4-sulfanylphenol [ACD/IUPAC Name]
3-Iodo-4-sulfanylphénol [French] [ACD/IUPAC Name]
Phenol, 3-iodo-4-mercapto- [ACD/Index Name]
1824578-54-2 [RN]
MFCD22481377

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

Density: 2.1±0.1 g/cm3
Boiling Point: 344.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.1±3.0 kJ/mol
Flash Point: 161.9±26.5 °C
Index of Refraction: 1.736
Molar Refractivity: 49.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 2.61
ACD/BCF (pH 5.5): 49.45
ACD/KOC (pH 5.5): 488.35
ACD/LogD (pH 7.4): 1.10
ACD/BCF (pH 7.4): 1.54
ACD/KOC (pH 7.4): 15.21
Polar Surface Area: 59 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 63.8±3.0 dyne/cm
Molar Volume: 122.5±3.0 cm3

Click to predict properties on the Chemicalize site


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