ChemSpider 2D Image | 5-Ethyl-4-fluoro-2-thiophenecarboxylic acid | C7H7FO2S

5-Ethyl-4-fluoro-2-thiophenecarboxylic acid

  • Molecular FormulaC7H7FO2S
  • Average mass174.193 Da
  • Monoisotopic mass174.015076 Da
  • ChemSpider ID44786290

More details:

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

2-Thiophenecarboxylic acid, 5-ethyl-4-fluoro- [ACD/Index Name]
5-Ethyl-4-fluor-2-thiophencarbonsäure [German] [ACD/IUPAC Name]
5-Ethyl-4-fluoro-2-thiophenecarboxylic acid [ACD/IUPAC Name]
Acide 5-éthyl-4-fluoro-2-thiophènecarboxylique [French] [ACD/IUPAC Name]
1557342-22-9 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 282.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 55.1±3.0 kJ/mol
Flash Point: 124.9±27.3 °C
Index of Refraction: 1.553
Molar Refractivity: 41.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.83
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 1.68
ACD/KOC (pH 5.5): 18.47
ACD/LogD (pH 7.4): -0.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 16.3±0.5 10-24cm3
Surface Tension: 46.9±3.0 dyne/cm
Molar Volume: 128.5±3.0 cm3

Click to predict properties on the Chemicalize site


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