ChemSpider 2D Image | Decyl 2,3,6-trifluorobenzyl phthalate | C25H29F3O4

Decyl 2,3,6-trifluorobenzyl phthalate

  • Molecular FormulaC25H29F3O4
  • Average mass450.491 Da
  • Monoisotopic mass450.201782 Da
  • ChemSpider ID29744645

More details:

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

1,2-Benzenedicarboxylic acid, decyl (2,3,6-trifluorophenyl)methyl ester [ACD/Index Name]
Decyl 2,3,6-trifluorobenzyl phthalate [ACD/IUPAC Name]
Decyl-2,3,6-trifluorbenzyl-phthalat [German] [ACD/IUPAC Name]
Phtalate de décyle et de 2,3,6-trifluorobenzyle [French] [ACD/IUPAC Name]
Phthalic acid, decyl 2,3,6-trifluorobenzyl ester

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

Density: 1.2±0.1 g/cm3
Boiling Point: 483.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 237.5±22.2 °C
Index of Refraction: 1.511
Molar Refractivity: 116.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 8.36
ACD/LogD (pH 5.5): 8.66
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1229303.75
ACD/LogD (pH 7.4): 8.66
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1229303.75
Polar Surface Area: 53 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 387.1±3.0 cm3

Click to predict properties on the Chemicalize site


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