ChemSpider 2D Image | S-[2-Furyl(~2~H_2_)methyl] ethanethioate | C7H6D2O2S

S-[2-Furyl(2H2)methyl] ethanethioate

  • Molecular FormulaC7H6D2O2S
  • Average mass158.214 Da
  • Monoisotopic mass158.037048 Da
  • ChemSpider ID48061094

  • Non-standard isotope - Non-standard isotope

More details:

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

Éthanethioate de S-[2-furyl(2H2)méthyle] [French] [ACD/IUPAC Name]
Ethanethioic acid, S-(2-furanylmethyl-d2) ester [ACD/Index Name]
S-[2-Furyl(2H2)methyl] ethanethioate [ACD/IUPAC Name]
S-[2-Furyl(2H2)methyl]-ethanthioat [German] [ACD/IUPAC Name]
1189712-86-4 [RN]
S-[(Furan-2-yl)(2H2)methyl] ethanethioate
S-[dideuterio(furan-2-yl)methyl] ethanethioate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 209.4±0.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.6±3.0 kJ/mol
Flash Point: 92.8±0.0 °C
Index of Refraction: 1.527
Molar Refractivity: 40.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.66
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.75
ACD/KOC (pH 5.5): 238.89
ACD/LogD (pH 7.4): 1.84
ACD/BCF (pH 7.4): 14.75
ACD/KOC (pH 7.4): 238.89
Polar Surface Area: 56 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 39.9±3.0 dyne/cm
Molar Volume: 132.6±3.0 cm3

Click to predict properties on the Chemicalize site


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