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ChemSpider 2D Image | 1-Phenylethyl {[methoxy(methylsulfanyl)phosphoryl]sulfanyl}acetate | C12H17O4PS2

1-Phenylethyl {[methoxy(methylsulfanyl)phosphoryl]sulfanyl}acetate

  • Molecular FormulaC12H17O4PS2
  • Average mass320.365 Da
  • Monoisotopic mass320.030579 Da
  • ChemSpider ID68056981

More details:






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

{[Méthoxy(méthylsulfanyl)phosphoryl]sulfanyl}acétate de 1-phényléthyle [French] [ACD/IUPAC Name]
1-Phenylethyl {[methoxy(methylsulfanyl)phosphoryl]sulfanyl}acetate [ACD/IUPAC Name]
1-Phenylethyl-{[methoxy(methylsulfanyl)phosphoryl]sulfanyl}acetat [German] [ACD/IUPAC Name]
Acetic acid, 2-[[methoxy(methylthio)phosphinyl]thio]-, 1-phenylethyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 409.6±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.2±3.0 kJ/mol
Flash Point: 201.5±29.3 °C
Index of Refraction: 1.556
Molar Refractivity: 80.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.23
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 178.24
ACD/KOC (pH 5.5): 1421.95
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 178.24
ACD/KOC (pH 7.4): 1421.95
Polar Surface Area: 113 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 251.0±3.0 cm3

Click to predict properties on the Chemicalize site






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