ChemSpider 2D Image | 3-Bromo-5-{[(5-chloro-2-thienyl)sulfonyl]amino}benzoic acid | C11H7BrClNO4S2

3-Bromo-5-{[(5-chloro-2-thienyl)sulfonyl]amino}benzoic acid

  • Molecular FormulaC11H7BrClNO4S2
  • Average mass396.665 Da
  • Monoisotopic mass394.868835 Da
  • ChemSpider ID37175238

More details:

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

3-Brom-5-{[(5-chlor-2-thienyl)sulfonyl]amino}benzoesäure [German] [ACD/IUPAC Name]
3-Bromo-5-{[(5-chloro-2-thienyl)sulfonyl]amino}benzoic acid [ACD/IUPAC Name]
Acide 3-bromo-5-{[(5-chloro-2-thiényl)sulfonyl]amino}benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-bromo-5-[[(5-chloro-2-thienyl)sulfonyl]amino]- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 557.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 291.2±32.9 °C
Index of Refraction: 1.703
Molar Refractivity: 80.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 1.92
ACD/BCF (pH 5.5): 5.30
ACD/KOC (pH 5.5): 28.92
ACD/LogD (pH 7.4): 0.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 120 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 77.3±3.0 dyne/cm
Molar Volume: 208.7±3.0 cm3

Click to predict properties on the Chemicalize site


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