ChemSpider 2D Image | 2-Bromo-5-(phenoxysulfonyl)benzoic acid | C13H9BrO5S

2-Bromo-5-(phenoxysulfonyl)benzoic acid

  • Molecular FormulaC13H9BrO5S
  • Average mass357.177 Da
  • Monoisotopic mass355.935394 Da
  • ChemSpider ID24450396

More details:

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

2-Brom-5-(phenoxysulfonyl)benzoesäure [German] [ACD/IUPAC Name]
2-Bromo-5-(phenoxysulfonyl)benzoic acid [ACD/IUPAC Name]
Acide 2-bromo-5-(phénoxysulfonyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-bromo-5-(phenoxysulfonyl)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 520.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.6±3.0 kJ/mol
Flash Point: 268.7±30.1 °C
Index of Refraction: 1.637
Molar Refractivity: 76.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.04
ACD/LogD (pH 7.4): 0.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.29
Polar Surface Area: 89 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 59.8±3.0 dyne/cm
Molar Volume: 211.8±3.0 cm3

Click to predict properties on the Chemicalize site


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