ChemSpider 2D Image | 2-Methyl-3-(2-methylphenyl)-4-oxo-3,4-dihydro-8-quinazolinyl 4-bromobenzenesulfonate | C22H17BrN2O4S

2-Methyl-3-(2-methylphenyl)-4-oxo-3,4-dihydro-8-quinazolinyl 4-bromobenzenesulfonate

  • Molecular FormulaC22H17BrN2O4S
  • Average mass485.350 Da
  • Monoisotopic mass484.009247 Da
  • ChemSpider ID30657504

More details:

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

2-Methyl-3-(2-methylphenyl)-4-oxo-3,4-dihydro-8-chinazolinyl-4-brombenzolsulfonat [German] [ACD/IUPAC Name]
2-Methyl-3-(2-methylphenyl)-4-oxo-3,4-dihydro-8-quinazolinyl 4-bromobenzenesulfonate [ACD/IUPAC Name]
4-Bromobenzènesulfonate de 2-méthyl-3-(2-méthylphényl)-4-oxo-3,4-dihydro-8-quinazolinyle [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 4-bromo-, 3,4-dihydro-2-methyl-3-(2-methylphenyl)-4-oxo-8-quinazolinyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 637.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.2±3.0 kJ/mol
Flash Point: 339.6±34.3 °C
Index of Refraction: 1.665
Molar Refractivity: 119.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.38
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 615.70
ACD/KOC (pH 5.5): 3453.24
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 615.72
ACD/KOC (pH 7.4): 3453.35
Polar Surface Area: 84 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 322.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement