ChemSpider 2D Image | O-(2-Furylmethyl) butanethioate | C9H12O2S

O-(2-Furylmethyl) butanethioate

  • Molecular FormulaC9H12O2S
  • Average mass184.255 Da
  • Monoisotopic mass184.055801 Da
  • ChemSpider ID24541379

More details:

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

Butanethioate de O-(2-furylméthyle) [French] [ACD/IUPAC Name]
Butanethioic acid, O-(2-furanylmethyl) ester [ACD/Index Name]
O-(2-Furylmethyl) butanethioate [ACD/IUPAC Name]
O-(2-Furylmethyl)-butanthioat [German] [ACD/IUPAC Name]
1-(2-furylmethoxy)butane-1-thione
Furfuryl thiobutyrate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 245.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.3±3.0 kJ/mol
Flash Point: 102.2±27.9 °C
Index of Refraction: 1.527
Molar Refractivity: 51.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.83
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 94.68
ACD/KOC (pH 5.5): 904.12
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 94.68
ACD/KOC (pH 7.4): 904.12
Polar Surface Area: 54 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 165.9±3.0 cm3

Click to predict properties on the Chemicalize site


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