ChemSpider 2D Image | 3-Nitrophenylethyl sulfide | C8H9NO2S

3-Nitrophenylethyl sulfide

  • Molecular FormulaC8H9NO2S
  • Average mass183.228 Da
  • Monoisotopic mass183.035400 Da
  • ChemSpider ID21513381

More details:

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

1-(Ethylsulfanyl)-3-nitrobenzene [ACD/IUPAC Name]
1-(Éthylsulfanyl)-3-nitrobenzène [French] [ACD/IUPAC Name]
1-(Ethylsulfanyl)-3-nitrobenzol [German] [ACD/IUPAC Name]
34126-43-7 [RN]
3-Nitro phenyl ethyl sulfide
3-Nitrophenylethyl sulfide
Benzene, 1-(ethylthio)-3-nitro- [ACD/Index Name]
Ethyl 3-nitrophenyl sulfide
[34126-43-7] [RN]
1-(ethylthio)-3-nitrobenzene
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 277.8±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 49.6±3.0 kJ/mol
Flash Point: 121.8±22.6 °C
Index of Refraction: 1.587
Molar Refractivity: 50.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.17
ACD/LogD (pH 5.5): 3.01
ACD/BCF (pH 5.5): 114.28
ACD/KOC (pH 5.5): 1034.44
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 114.28
ACD/KOC (pH 7.4): 1034.44
Polar Surface Area: 71 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 48.6±5.0 dyne/cm
Molar Volume: 149.0±5.0 cm3

Click to predict properties on the Chemicalize site


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