ChemSpider 2D Image | 2-(3,4-Difluorophenyl)-1-(3-thienyl)ethanone | C12H8F2OS

2-(3,4-Difluorophenyl)-1-(3-thienyl)ethanone

  • Molecular FormulaC12H8F2OS
  • Average mass238.253 Da
  • Monoisotopic mass238.026398 Da
  • ChemSpider ID35811162

More details:

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

2-(3,4-Difluorophenyl)-1-(3-thienyl)ethanone [ACD/IUPAC Name]
2-(3,4-Difluorophényl)-1-(3-thiényl)éthanone [French] [ACD/IUPAC Name]
2-(3,4-Difluorphenyl)-1-(3-thienyl)ethanon [German] [ACD/IUPAC Name]
Ethanone, 2-(3,4-difluorophenyl)-1-(3-thienyl)- [ACD/Index 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: 332.8±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.6±3.0 kJ/mol
Flash Point: 155.1±25.1 °C
Index of Refraction: 1.573
Molar Refractivity: 59.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.97
ACD/LogD (pH 5.5): 3.21
ACD/BCF (pH 5.5): 162.44
ACD/KOC (pH 5.5): 1330.53
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 162.44
ACD/KOC (pH 7.4): 1330.53
Polar Surface Area: 45 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 43.8±3.0 dyne/cm
Molar Volume: 179.6±3.0 cm3

Click to predict properties on the Chemicalize site


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