ChemSpider 2D Image | 2-Bromo-6-sulfanylphenol | C6H5BrOS

2-Bromo-6-sulfanylphenol

  • Molecular FormulaC6H5BrOS
  • Average mass205.072 Da
  • Monoisotopic mass203.924438 Da
  • ChemSpider ID60833809

More details:

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

2-Brom-6-sulfanylphenol [German] [ACD/IUPAC Name]
2-Bromo-6-sulfanylphenol [ACD/IUPAC Name]
2-Bromo-6-sulfanylphénol [French] [ACD/IUPAC Name]
Phenol, 2-bromo-6-mercapto- [ACD/Index Name]
336863-82-2 [RN]
MFCD22481196

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

Density: 1.8±0.1 g/cm3
Boiling Point: 242.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.9±3.0 kJ/mol
Flash Point: 100.4±24.6 °C
Index of Refraction: 1.678
Molar Refractivity: 44.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 31.93
ACD/KOC (pH 5.5): 345.01
ACD/LogD (pH 7.4): 0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.35
Polar Surface Area: 59 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 57.5±3.0 dyne/cm
Molar Volume: 116.7±3.0 cm3

Click to predict properties on the Chemicalize site


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