Found 225 results

Search term: MF = 'C_{9}H_{12}O_{2}S_{2}'
ChemSpider 2D Image | 4,5-Bis(ethylsulfanyl)-4-cyclopentene-1,3-dione | C9H12O2S2

4,5-Bis(ethylsulfanyl)-4-cyclopentene-1,3-dione

  • Molecular FormulaC9H12O2S2
  • Average mass216.320 Da
  • Monoisotopic mass216.027863 Da
  • ChemSpider ID28549155

More details:

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

4,5-Bis(ethylsulfanyl)-4-cyclopenten-1,3-dion [German] [ACD/IUPAC Name]
4,5-Bis(ethylsulfanyl)-4-cyclopentene-1,3-dione [ACD/IUPAC Name]
4,5-Bis(éthylsulfanyl)-4-cyclopentène-1,3-dione [French] [ACD/IUPAC Name]
4-Cyclopentene-1,3-dione, 4,5-bis(ethylthio)- [ACD/Index Name]
4,5-Bis(ethylsulfanyl)cyclopent-4-ene-1,3-dione
4,5-diethylthio-4-cyclopenten-1,3-dione
929116-16-5 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 314.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.6±3.0 kJ/mol
Flash Point: 132.6±17.9 °C
Index of Refraction: 1.573
Molar Refractivity: 57.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.17
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 6.59
ACD/KOC (pH 5.5): 116.99
ACD/LogD (pH 7.4): 0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.33
Polar Surface Area: 85 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 47.0±5.0 dyne/cm
Molar Volume: 174.2±5.0 cm3

Click to predict properties on the Chemicalize site


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