ChemSpider 2D Image | Methyl (2E)-5,5-bis(ethylsulfanyl)-2,4-pentadienoate | C10H16O2S2

Methyl (2E)-5,5-bis(ethylsulfanyl)-2,4-pentadienoate

  • Molecular FormulaC10H16O2S2
  • Average mass232.363 Da
  • Monoisotopic mass232.059174 Da
  • ChemSpider ID57517753

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-5,5-Bis(éthylsulfanyl)-2,4-pentadiénoate de méthyle [French] [ACD/IUPAC Name]
2,4-Pentadienoic acid, 5,5-bis(ethylthio)-, methyl ester, (2E)- [ACD/Index Name]
Methyl (2E)-5,5-bis(ethylsulfanyl)-2,4-pentadienoate [ACD/IUPAC Name]
Methyl-(2E)-5,5-bis(ethylsulfanyl)-2,4-pentadienoat [German] [ACD/IUPAC Name]
112633-98-4 [RN]
METHYL (2E)-5,5-BIS(ETHYLSULFANYL)PENTA-2,4-DIENOATE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 347.7±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.2±3.0 kJ/mol
Flash Point: 162.7±14.5 °C
Index of Refraction: 1.536
Molar Refractivity: 66.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 3.19
ACD/BCF (pH 5.5): 155.93
ACD/KOC (pH 5.5): 1292.16
ACD/LogD (pH 7.4): 3.19
ACD/BCF (pH 7.4): 155.93
ACD/KOC (pH 7.4): 1292.16
Polar Surface Area: 77 Å2
Polarizability: 26.2±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 212.1±3.0 cm3

Click to predict properties on the Chemicalize site


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