ChemSpider 2D Image | (3-Methyl-3-oxetanyl)methyl (2E)-3-(4-chlorophenyl)-4,4,4-trifluoro-2-butenoate | C15H14ClF3O3

(3-Methyl-3-oxetanyl)methyl (2E)-3-(4-chlorophenyl)-4,4,4-trifluoro-2-butenoate

  • Molecular FormulaC15H14ClF3O3
  • Average mass334.718 Da
  • Monoisotopic mass334.058350 Da
  • ChemSpider ID71303946

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(4-Chlorophényl)-4,4,4-trifluoro-2-buténoate de (3-méthyl-3-oxétanyl)méthyle [French] [ACD/IUPAC Name]
(3-Methyl-3-oxetanyl)methyl (2E)-3-(4-chlorophenyl)-4,4,4-trifluoro-2-butenoate [ACD/IUPAC Name]
(3-Methyl-3-oxetanyl)methyl-(2E)-3-(4-chlorphenyl)-4,4,4-trifluor-2-butenoat [German] [ACD/IUPAC Name]
2-Butenoic acid, 3-(4-chlorophenyl)-4,4,4-trifluoro-, (3-methyl-3-oxetanyl)methyl ester, (2E)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 394.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.4±3.0 kJ/mol
Flash Point: 147.2±17.0 °C
Index of Refraction: 1.502
Molar Refractivity: 75.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 3.87
ACD/BCF (pH 5.5): 517.18
ACD/KOC (pH 5.5): 3048.09
ACD/LogD (pH 7.4): 3.87
ACD/BCF (pH 7.4): 517.18
ACD/KOC (pH 7.4): 3048.09
Polar Surface Area: 36 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 255.1±3.0 cm3

Click to predict properties on the Chemicalize site


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