Found 34 results

Search term: MF = 'C_{18}H_{17}FO_{3}S'
ChemSpider 2D Image | 2-(3,4-Dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(4-fluorophenyl)-1-propanone | C18H17FO3S

2-(3,4-Dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(4-fluorophenyl)-1-propanone

  • Molecular FormulaC18H17FO3S
  • Average mass332.389 Da
  • Monoisotopic mass332.088257 Da
  • ChemSpider ID21982201

More details:

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

1-Propanone, 2-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thio]-1-(4-fluorophenyl)- [ACD/Index Name]
2-(3,4-Dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(4-fluorophenyl)-1-propanone [ACD/IUPAC Name]
2-(3,4-Dihydro-2H-1,5-benzodioxépin-7-ylsulfanyl)-1-(4-fluorophényl)-1-propanone [French] [ACD/IUPAC Name]
2-(3,4-Dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-1-(4-fluorphenyl)-1-propanon [German] [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: 466.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.8±3.0 kJ/mol
Flash Point: 235.6±28.7 °C
Index of Refraction: 1.607
Molar Refractivity: 88.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 4.04
ACD/BCF (pH 5.5): 693.53
ACD/KOC (pH 5.5): 3760.42
ACD/LogD (pH 7.4): 4.04
ACD/BCF (pH 7.4): 693.53
ACD/KOC (pH 7.4): 3760.42
Polar Surface Area: 61 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 51.3±5.0 dyne/cm
Molar Volume: 257.3±5.0 cm3

Click to predict properties on the Chemicalize site


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