ChemSpider 2D Image | 3-(2-Bromobenzyl)-7-fluoro-4(3H)-quinazolinone | C15H10BrFN2O

3-(2-Bromobenzyl)-7-fluoro-4(3H)-quinazolinone

  • Molecular FormulaC15H10BrFN2O
  • Average mass333.155 Da
  • Monoisotopic mass331.996033 Da
  • ChemSpider ID22802134

More details:

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

3-(2-Brombenzyl)-7-fluor-4(3H)-chinazolinon [German] [ACD/IUPAC Name]
3-(2-Bromobenzyl)-7-fluoro-4(3H)-quinazolinone [ACD/IUPAC Name]
3-(2-Bromobenzyl)-7-fluoro-4(3H)-quinazolinone [French] [ACD/IUPAC Name]
4(3H)-Quinazolinone, 3-[(2-bromophenyl)methyl]-7-fluoro- [ACD/Index Name]
3-[(2-BROMOPHENYL)METHYL]-7-FLUOROQUINAZOLIN-4-ONE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 476.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.0±3.0 kJ/mol
Flash Point: 241.7±31.5 °C
Index of Refraction: 1.652
Molar Refractivity: 79.3±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 3.68
ACD/BCF (pH 5.5): 370.89
ACD/KOC (pH 5.5): 2402.53
ACD/LogD (pH 7.4): 3.68
ACD/BCF (pH 7.4): 370.89
ACD/KOC (pH 7.4): 2402.54
Polar Surface Area: 33 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 48.6±7.0 dyne/cm
Molar Volume: 216.8±7.0 cm3

Click to predict properties on the Chemicalize site


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