ChemSpider 2D Image | 2-Phenylethyl 3-[2-(2,4-dibromophenoxy)acetoxy]benzoate | C23H18Br2O5

2-Phenylethyl 3-[2-(2,4-dibromophenoxy)acetoxy]benzoate

  • Molecular FormulaC23H18Br2O5
  • Average mass534.194 Da
  • Monoisotopic mass531.952087 Da
  • ChemSpider ID20691754

More details:

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

2-Phenylethyl 3-[2-(2,4-dibromophenoxy)acetoxy]benzoate [ACD/IUPAC Name]
2-Phenylethyl-3-[2-(2,4-dibromphenoxy)acetoxy]benzoat [German] [ACD/IUPAC Name]
3-[2-(2,4-Dibromophénoxy)acétoxy]benzoate de 2-phényléthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-[[2-(2,4-dibromophenoxy)acetyl]oxy]-, 2-phenylethyl ester [ACD/Index Name]
2-phenylethyl 3-{[(2,4-dibromophenoxy)acetyl]oxy}benzoate
benzoic acid, 3-[[(2,4-dibromophenoxy)acetyl]oxy]-, 2-phenylethyl ester

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

Density: 1.6±0.1 g/cm3
Boiling Point: 613.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 324.8±31.5 °C
Index of Refraction: 1.618
Molar Refractivity: 120.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.98
ACD/LogD (pH 5.5): 6.61
ACD/BCF (pH 5.5): 61679.13
ACD/KOC (pH 5.5): 93403.29
ACD/LogD (pH 7.4): 6.61
ACD/BCF (pH 7.4): 61679.13
ACD/KOC (pH 7.4): 93403.29
Polar Surface Area: 62 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 51.5±3.0 dyne/cm
Molar Volume: 342.9±3.0 cm3

Click to predict properties on the Chemicalize site


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