ChemSpider 2D Image | 2,3,5,6-Tetrafluorobenzyl (1R,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate | C15H12Cl2F4O2

2,3,5,6-Tetrafluorobenzyl (1R,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate

  • Molecular FormulaC15H12Cl2F4O2
  • Average mass371.154 Da
  • Monoisotopic mass370.015045 Da
  • ChemSpider ID62492779
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(1R,3R)-3-(2,2-Dichlorovinyl)-2,2-diméthylcyclopropanecarboxylate de 2,3,5,6-tétrafluorobenzyle [French] [ACD/IUPAC Name]
2,3,5,6-Tetrafluorbenzyl-(1R,3R)-3-(2,2-dichlorvinyl)-2,2-dimethylcyclopropancarboxylat [German] [ACD/IUPAC Name]
2,3,5,6-Tetrafluorobenzyl (1R,3R)-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, (2,3,5,6-tetrafluorophenyl)methyl ester, (1R,3R)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 351.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.6±3.0 kJ/mol
Flash Point: 115.5±17.0 °C
Index of Refraction: 1.550
Molar Refractivity: 79.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.40
ACD/LogD (pH 5.5): 5.45
ACD/BCF (pH 5.5): 8236.11
ACD/KOC (pH 5.5): 22103.67
ACD/LogD (pH 7.4): 5.45
ACD/BCF (pH 7.4): 8236.11
ACD/KOC (pH 7.4): 22103.67
Polar Surface Area: 26 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 248.8±3.0 cm3

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