ChemSpider 2D Image | 2-[(Hydroxymethyl)disulfanyl]ethyl acetate | C5H10O3S2

2-[(Hydroxymethyl)disulfanyl]ethyl acetate

  • Molecular FormulaC5H10O3S2
  • Average mass182.261 Da
  • Monoisotopic mass182.007141 Da
  • ChemSpider ID61001936

More details:

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

2-[(Hydroxymethyl)disulfanyl]ethyl acetate [ACD/IUPAC Name]
2-[(Hydroxymethyl)disulfanyl]ethyl-acetat [German] [ACD/IUPAC Name]
Acétate de 2-[(hydroxyméthyl)disulfanyl]éthyle [French] [ACD/IUPAC Name]
Ethanol, 2-[(hydroxymethyl)dithio]-, acetate [ACD/Index Name]
1001648-68-5 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 266.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 58.6±6.0 kJ/mol
Flash Point: 115.0±23.2 °C
Index of Refraction: 1.549
Molar Refractivity: 44.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.24
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 4.12
ACD/KOC (pH 5.5): 95.84
ACD/LogD (pH 7.4): 1.11
ACD/BCF (pH 7.4): 4.12
ACD/KOC (pH 7.4): 95.84
Polar Surface Area: 97 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 50.9±3.0 dyne/cm
Molar Volume: 140.0±3.0 cm3

Click to predict properties on the Chemicalize site


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