ChemSpider 2D Image | Methyl (2E)-3-{2-[(2-methyl-2-propanyl)sulfanyl]phenyl}acrylate | C14H18O2S

Methyl (2E)-3-{2-[(2-methyl-2-propanyl)sulfanyl]phenyl}acrylate

  • Molecular FormulaC14H18O2S
  • Average mass250.357 Da
  • Monoisotopic mass250.102753 Da
  • ChemSpider ID21187423

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-{2-[(2-Méthyl-2-propanyl)sulfanyl]phényl}acrylate de méthyle [French] [ACD/IUPAC Name]
2-Propenoic acid, 3-[2-[(1,1-dimethylethyl)thio]phenyl]-, methyl ester, (2E)- [ACD/Index Name]
Methyl (2E)-3-{2-[(2-methyl-2-propanyl)sulfanyl]phenyl}acrylate [ACD/IUPAC Name]
Methyl-(2E)-3-{2-[(2-methyl-2-propanyl)sulfanyl]phenyl}acrylat [German] [ACD/IUPAC Name]
Methyl (2E)-3-[2-(tert-butylsulfanyl)phenyl]acrylate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 350.1±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.5±3.0 kJ/mol
Flash Point: 159.2±11.2 °C
Index of Refraction: 1.547
Molar Refractivity: 73.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.89
ACD/LogD (pH 5.5): 3.95
ACD/BCF (pH 5.5): 588.78
ACD/KOC (pH 5.5): 3344.52
ACD/LogD (pH 7.4): 3.95
ACD/BCF (pH 7.4): 588.78
ACD/KOC (pH 7.4): 3344.52
Polar Surface Area: 52 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 40.1±5.0 dyne/cm
Molar Volume: 232.1±5.0 cm3

Click to predict properties on the Chemicalize site


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