ChemSpider 2D Image | 5-({2-[(Trifluoromethyl)sulfanyl]ethyl}sulfinyl)-2-furoic acid | C8H7F3O4S2

5-({2-[(Trifluoromethyl)sulfanyl]ethyl}sulfinyl)-2-furoic acid

  • Molecular FormulaC8H7F3O4S2
  • Average mass288.264 Da
  • Monoisotopic mass287.973785 Da
  • ChemSpider ID43922271

More details:

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

2-Furancarboxylic acid, 5-[[2-[(trifluoromethyl)thio]ethyl]sulfinyl]- [ACD/Index Name]
5-({2-[(Trifluormethyl)sulfanyl]ethyl}sulfinyl)-2-furoesäure [German] [ACD/IUPAC Name]
5-({2-[(Trifluoromethyl)sulfanyl]ethyl}sulfinyl)-2-furoic acid [ACD/IUPAC Name]
Acide 5-({2-[(trifluorométhyl)sulfanyl]éthyl}sulfinyl)-2-furoïque [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 442.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 221.3±28.7 °C
Index of Refraction: 1.570
Molar Refractivity: 56.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.39
ACD/LogD (pH 5.5): -0.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 64.1±5.0 dyne/cm
Molar Volume: 172.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement