Found 3 results

Search term: YPGYLCZBZKRYQJ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2,5-Bis{[2,2,2-trifluoro(~2~H_2_)ethyl]oxy}benzoic acid | C11H4D4F6O4

2,5-Bis{[2,2,2-trifluoro(2H2)ethyl]oxy}benzoic acid

  • Molecular FormulaC11H4D4F6O4
  • Average mass322.194 Da
  • Monoisotopic mass322.057770 Da
  • ChemSpider ID115008828

  • Non-standard isotope - Non-standard isotope

More details:

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

2,5-Bis{[2,2,2-trifluor(2H2)ethyl]oxy}benzoesäure [German] [ACD/IUPAC Name]
2,5-Bis{[2,2,2-trifluoro(2H2)ethyl]oxy}benzoic acid [ACD/IUPAC Name]
Acide 2,5-bis{[2,2,2-trifluoro(2H2)éthyl]oxy}benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2,5-bis[(2,2,2-trifluoroethyl-1,1-d2)oxy]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 320.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.4±3.0 kJ/mol
Flash Point: 147.9±27.9 °C
Index of Refraction: 1.439
Molar Refractivity: 56.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 1.62
ACD/KOC (pH 5.5): 10.49
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.82
Polar Surface Area: 56 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 31.1±3.0 dyne/cm
Molar Volume: 215.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement