ChemSpider 2D Image | 1-(5-Iodo-3-thienyl)-2-methyl-2-propen-1-one | C8H7IOS

1-(5-Iodo-3-thienyl)-2-methyl-2-propen-1-one

  • Molecular FormulaC8H7IOS
  • Average mass278.110 Da
  • Monoisotopic mass277.926208 Da
  • ChemSpider ID41692159

More details:

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

1-(5-Iod-3-thienyl)-2-methyl-2-propen-1-on [German] [ACD/IUPAC Name]
1-(5-Iodo-3-thienyl)-2-methyl-2-propen-1-one [ACD/IUPAC Name]
1-(5-Iodo-3-thiényl)-2-méthyl-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-(5-iodo-3-thienyl)-2-methyl- [ACD/Index Name]
1597635-52-3 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 312.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 142.8±27.9 °C
Index of Refraction: 1.621
Molar Refractivity: 56.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.64
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 202.80
ACD/KOC (pH 5.5): 1559.60
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 202.80
ACD/KOC (pH 7.4): 1559.60
Polar Surface Area: 45 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 45.2±3.0 dyne/cm
Molar Volume: 160.4±3.0 cm3

Click to predict properties on the Chemicalize site


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