ChemSpider 2D Image | 2-[(Hydroxymethyl)sulfanyl]ethanol | C3H8O2S

2-[(Hydroxymethyl)sulfanyl]ethanol

  • Molecular FormulaC3H8O2S
  • Average mass108.159 Da
  • Monoisotopic mass108.024498 Da
  • ChemSpider ID60999729

More details:






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

2-[(Hydroxymethyl)sulfanyl]ethanol [German] [ACD/IUPAC Name]
2-[(Hydroxymethyl)sulfanyl]ethanol [ACD/IUPAC Name]
2-[(Hydroxyméthyl)sulfanyl]éthanol [French] [ACD/IUPAC Name]
Ethanol, 2-[(hydroxymethyl)thio]- [ACD/Index Name]
876503-58-1 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 256.3±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 57.4±6.0 kJ/mol
Flash Point: 125.2±20.5 °C
Index of Refraction: 1.533
Molar Refractivity: 27.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.77
ACD/LogD (pH 5.5): -0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 9.65
ACD/LogD (pH 7.4): -0.72
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.65
Polar Surface Area: 66 Å2
Polarizability: 10.7±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 87.0±3.0 cm3

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