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Search term: ZPSDVAZZKOUZNL (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-Fluoro-3-isocyanato-5-sulfanylphenol | C7H4FNO2S

2-Fluoro-3-isocyanato-5-sulfanylphenol

  • Molecular FormulaC7H4FNO2S
  • Average mass185.176 Da
  • Monoisotopic mass184.994675 Da
  • ChemSpider ID75637303

More details:

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

2-Fluor-3-isocyanato-5-sulfanylphenol [German] [ACD/IUPAC Name]
2-Fluoro-3-isocyanato-5-sulfanylphenol [ACD/IUPAC Name]
2-Fluoro-3-isocyanato-5-sulfanylphénol [French] [ACD/IUPAC Name]
Phenol, 2-fluoro-3-isocyanato-5-mercapto- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 338.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 158.5±27.9 °C
Index of Refraction: 1.610
Molar Refractivity: 44.2±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 47.53
ACD/KOC (pH 5.5): 470.49
ACD/LogD (pH 7.4): 1.03
ACD/BCF (pH 7.4): 1.32
ACD/KOC (pH 7.4): 13.07
Polar Surface Area: 88 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 44.8±7.0 dyne/cm
Molar Volume: 127.5±7.0 cm3

Click to predict properties on the Chemicalize site


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