ChemSpider 2D Image | 1-(4-Chloro-2,5-dihydroxyphenyl)-2-(2-thienyl)ethanone | C12H9ClO3S

1-(4-Chloro-2,5-dihydroxyphenyl)-2-(2-thienyl)ethanone

  • Molecular FormulaC12H9ClO3S
  • Average mass268.716 Da
  • Monoisotopic mass267.996094 Da
  • ChemSpider ID32057431

More details:






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

1-(4-Chlor-2,5-dihydroxyphenyl)-2-(2-thienyl)ethanon [German] [ACD/IUPAC Name]
1-(4-Chloro-2,5-dihydroxyphenyl)-2-(2-thienyl)ethanone [ACD/IUPAC Name]
1-(4-Chloro-2,5-dihydroxyphényl)-2-(2-thiényl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-(4-chloro-2,5-dihydroxyphenyl)-2-(2-thienyl)- [ACD/Index Name]
1-(4-chloro-2,5-dihydroxyphenyl)-2-(thiophen-2-yl)ethan-1-one
1-(4-Chloro-2,5-dihydroxyphenyl)-2-(thiophen-2-yl)ethanone
951235-97-5 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 463.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.2±3.0 kJ/mol
Flash Point: 233.9±28.7 °C
Index of Refraction: 1.678
Molar Refractivity: 67.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 467.33
ACD/KOC (pH 5.5): 2825.42
ACD/LogD (pH 7.4): 3.53
ACD/BCF (pH 7.4): 243.45
ACD/KOC (pH 7.4): 1471.83
Polar Surface Area: 86 Å2
Polarizability: 26.9±0.5 10-24cm3
Surface Tension: 66.4±3.0 dyne/cm
Molar Volume: 180.0±3.0 cm3

Click to predict properties on the Chemicalize site






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