ChemSpider 2D Image | Ethyl [(S)-phenylsulfinyl]acetate | C10H12O3S

Ethyl [(S)-phenylsulfinyl]acetate

  • Molecular FormulaC10H12O3S
  • Average mass212.266 Da
  • Monoisotopic mass212.050720 Da
  • ChemSpider ID113056528

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[(S)-Phénylsulfinyl]acétate d'éthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-[(S)-phenylsulfinyl]-, ethyl ester [ACD/Index Name]
Ethyl [(S)-phenylsulfinyl]acetate [ACD/IUPAC Name]
Ethyl-[(S)-phenylsulfinyl]acetat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 359.0±25.0 °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: 170.9±23.2 °C
Index of Refraction: 1.574
Molar Refractivity: 56.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.26
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 5.37
ACD/KOC (pH 5.5): 115.88
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 5.37
ACD/KOC (pH 7.4): 115.88
Polar Surface Area: 63 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 55.0±5.0 dyne/cm
Molar Volume: 169.8±5.0 cm3

Click to predict properties on the Chemicalize site


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