ChemSpider 2D Image | 2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(4-methoxyphenyl)-1-propanone | C18H18O4S

2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(4-methoxyphenyl)-1-propanone

  • Molecular FormulaC18H18O4S
  • Average mass330.398 Da
  • Monoisotopic mass330.092590 Da
  • ChemSpider ID22016841

More details:

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

1-Propanone, 2-[(2,3-dihydro-1,4-benzodioxin-6-yl)thio]-1-(4-methoxyphenyl)- [ACD/Index Name]
2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(4-methoxyphenyl)-1-propanon [German] [ACD/IUPAC Name]
2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(4-methoxyphenyl)-1-propanone [ACD/IUPAC Name]
2-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfanyl)-1-(4-méthoxyphényl)-1-propanone [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 493.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.0±3.0 kJ/mol
Flash Point: 247.7±16.7 °C
Index of Refraction: 1.618
Molar Refractivity: 90.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 3.76
ACD/BCF (pH 5.5): 420.35
ACD/KOC (pH 5.5): 2627.76
ACD/LogD (pH 7.4): 3.76
ACD/BCF (pH 7.4): 420.35
ACD/KOC (pH 7.4): 2627.76
Polar Surface Area: 70 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 53.8±5.0 dyne/cm
Molar Volume: 258.4±5.0 cm3

Click to predict properties on the Chemicalize site


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