ChemSpider 2D Image | 3-Bromo-2-fluoro-5,6-dimethoxybenzoic acid | C9H8BrFO4

3-Bromo-2-fluoro-5,6-dimethoxybenzoic acid

  • Molecular FormulaC9H8BrFO4
  • Average mass279.060 Da
  • Monoisotopic mass277.958984 Da
  • ChemSpider ID61961340

More details:

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

3-Brom-2-fluor-5,6-dimethoxybenzoesäure [German] [ACD/IUPAC Name]
3-Bromo-2-fluoro-5,6-dimethoxybenzoic acid [ACD/IUPAC Name]
Acide 3-bromo-2-fluoro-5,6-diméthoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-bromo-2-fluoro-5,6-dimethoxy- [ACD/Index Name]
1892245-77-0 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 337.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.3±3.0 kJ/mol
Flash Point: 158.0±27.9 °C
Index of Refraction: 1.549
Molar Refractivity: 54.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.60
ACD/LogD (pH 7.4): -0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 56 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 170.4±3.0 cm3

Click to predict properties on the Chemicalize site


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