ChemSpider 2D Image | Methyl 6-bromo-2-fluoro-3-[(~2~H_3_)methyloxy]benzoate | C9H5D3BrFO3

Methyl 6-bromo-2-fluoro-3-[(2H3)methyloxy]benzoate

  • Molecular FormulaC9H5D3BrFO3
  • Average mass266.079 Da
  • Monoisotopic mass264.982910 Da
  • ChemSpider ID122654891

  • Non-standard isotope - Non-standard isotope

More details:

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

6-Bromo-2-fluoro-3-[(2H3)méthyloxy]benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 6-bromo-2-fluoro-3-(methyl-d3-oxy)-, methyl ester [ACD/Index Name]
Methyl 6-bromo-2-fluoro-3-[(2H3)methyloxy]benzoate [ACD/IUPAC Name]
Methyl-6-brom-2-fluor-3-[(2H3)methyloxy]benzoat [German] [ACD/IUPAC 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: 307.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.8±3.0 kJ/mol
Flash Point: 139.5±27.9 °C
Index of Refraction: 1.522
Molar Refractivity: 52.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.38
ACD/LogD (pH 5.5): 3.02
ACD/BCF (pH 5.5): 115.48
ACD/KOC (pH 5.5): 1042.21
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 115.48
ACD/KOC (pH 7.4): 1042.21
Polar Surface Area: 36 Å2
Polarizability: 20.8±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 171.7±3.0 cm3

Click to predict properties on the Chemicalize site


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