Found 434 results

Search term: MF = 'C_{23}H_{24}BrNO_{4}'
ChemSpider 2D Image | 1-(4-Bromophenyl)-4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-1,4-butanedione | C23H24BrNO4

1-(4-Bromophenyl)-4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-1,4-butanedione

  • Molecular FormulaC23H24BrNO4
  • Average mass458.345 Da
  • Monoisotopic mass457.088867 Da
  • ChemSpider ID21775860

More details:

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

1-(4-Bromophenyl)-4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-1,4-butanedione [ACD/IUPAC Name]
1-(4-Bromophényl)-4-[2-(3,4-dihydro-2H-1,5-benzodioxépin-7-yl)-1-pyrrolidinyl]-1,4-butanedione [French] [ACD/IUPAC Name]
1-(4-Bromphenyl)-4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-1,4-butandion [German] [ACD/IUPAC Name]
1,4-Butanedione, 1-(4-bromophenyl)-4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 626.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 332.7±31.5 °C
Index of Refraction: 1.599
Molar Refractivity: 113.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 4.18
ACD/BCF (pH 5.5): 885.88
ACD/KOC (pH 5.5): 4480.53
ACD/LogD (pH 7.4): 4.18
ACD/BCF (pH 7.4): 885.88
ACD/KOC (pH 7.4): 4480.53
Polar Surface Area: 56 Å2
Polarizability: 44.8±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 330.5±3.0 cm3

Click to predict properties on the Chemicalize site


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