ChemSpider 2D Image | (2S,4S)-2,4-Dimethylthietane | C5H10S

(2S,4S)-2,4-Dimethylthietane

  • Molecular FormulaC5H10S
  • Average mass102.198 Da
  • Monoisotopic mass102.050323 Da
  • ChemSpider ID57535957

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,4S)-2,4-Dimethylthietan [German] [ACD/IUPAC Name]
(2S,4S)-2,4-Dimethylthietane [ACD/IUPAC Name]
(2S,4S)-2,4-Diméthylthiétane [French] [ACD/IUPAC Name]
Thietane, 2,4-dimethyl-, (2S,4S)- [ACD/Index Name]
23291-51-2 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 118.5±8.0 °C at 760 mmHg
Vapour Pressure: 19.8±0.2 mmHg at 25°C
Enthalpy of Vaporization: 34.2±3.0 kJ/mol
Flash Point: 18.6±15.1 °C
Index of Refraction: 1.481
Molar Refractivity: 31.4±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): 2.17
ACD/BCF (pH 5.5): 26.17
ACD/KOC (pH 5.5): 360.15
ACD/LogD (pH 7.4): 2.17
ACD/BCF (pH 7.4): 26.17
ACD/KOC (pH 7.4): 360.15
Polar Surface Area: 25 Å2
Polarizability: 12.5±0.5 10-24cm3
Surface Tension: 28.1±3.0 dyne/cm
Molar Volume: 110.4±3.0 cm3

Click to predict properties on the Chemicalize site


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