ChemSpider 2D Image | 5-Bromo-2,3-difluoro-4-isopropoxybenzoic acid | C10H9BrF2O3

5-Bromo-2,3-difluoro-4-isopropoxybenzoic acid

  • Molecular FormulaC10H9BrF2O3
  • Average mass295.078 Da
  • Monoisotopic mass293.970306 Da
  • ChemSpider ID114990328

More details:

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

5-Brom-2,3-difluor-4-isopropoxybenzoesäure [German] [ACD/IUPAC Name]
5-Bromo-2,3-difluoro-4-isopropoxybenzoic acid [ACD/IUPAC Name]
Acide 5-bromo-2,3-difluoro-4-isopropoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 5-bromo-2,3-difluoro-4-(1-methylethoxy)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 326.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 60.0±3.0 kJ/mol
Flash Point: 151.1±27.9 °C
Index of Refraction: 1.529
Molar Refractivity: 56.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 0.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.52
ACD/LogD (pH 7.4): 0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.28
Polar Surface Area: 47 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 184.0±3.0 cm3

Click to predict properties on the Chemicalize site


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