ChemSpider 2D Image | 6-Bromo-3-(carboxymethyl)-2-(3,4-dimethylphenyl)-4-quinolinecarboxylic acid | C20H16BrNO4

6-Bromo-3-(carboxymethyl)-2-(3,4-dimethylphenyl)-4-quinolinecarboxylic acid

  • Molecular FormulaC20H16BrNO4
  • Average mass414.249 Da
  • Monoisotopic mass413.026276 Da
  • ChemSpider ID24808403

More details:

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

3-Quinolineacetic acid, 6-bromo-4-carboxy-2-(3,4-dimethylphenyl)- [ACD/Index Name]
6-Brom-3-(carboxymethyl)-2-(3,4-dimethylphenyl)-4-chinolincarbonsäure [German] [ACD/IUPAC Name]
6-Bromo-3-(carboxymethyl)-2-(3,4-dimethylphenyl)-4-quinolinecarboxylic acid [ACD/IUPAC Name]
Acide 6-bromo-3-(carboxyméthyl)-2-(3,4-diméthylphényl)-4-quinoléinecarboxylique [French] [ACD/IUPAC Name]
Kinome_3398

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

Density: 1.5±0.1 g/cm3
Boiling Point: 606.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.7±3.0 kJ/mol
Flash Point: 320.3±31.5 °C
Index of Refraction: 1.679
Molar Refractivity: 102.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.94
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.49
ACD/LogD (pH 7.4): 0.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 63.7±3.0 dyne/cm
Molar Volume: 270.8±3.0 cm3

Click to predict properties on the Chemicalize site


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