ChemSpider 2D Image | 3-Iodo-5,6-dihydro-1-benzothiophen-7(4H)-one | C8H7IOS

3-Iodo-5,6-dihydro-1-benzothiophen-7(4H)-one

  • Molecular FormulaC8H7IOS
  • Average mass278.110 Da
  • Monoisotopic mass277.926208 Da
  • ChemSpider ID21416443

More details:

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

3-Iod-5,6-dihydro-1-benzothiophen-7(4H)-on [German] [ACD/IUPAC Name]
3-Iodo-5,6-dihydro-1-benzothiophen-7(4H)-one [ACD/IUPAC Name]
3-Iodo-5,6-dihydro-1-benzothiophén-7(4H)-one [French] [ACD/IUPAC Name]
Benzo[b]thiophen-7(4H)-one, 5,6-dihydro-3-iodo- [ACD/Index Name]
3-Iodo-5,6-dihydrobenzo[b]thiophen-7(4H)-one

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

Density: 1.9±0.1 g/cm3
Boiling Point: 356.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.2±3.0 kJ/mol
Flash Point: 169.4±27.9 °C
Index of Refraction: 1.679
Molar Refractivity: 54.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.23
ACD/LogD (pH 5.5): 3.00
ACD/BCF (pH 5.5): 112.15
ACD/KOC (pH 5.5): 1020.59
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 112.15
ACD/KOC (pH 7.4): 1020.59
Polar Surface Area: 45 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 57.0±3.0 dyne/cm
Molar Volume: 144.3±3.0 cm3

Click to predict properties on the Chemicalize site


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