ChemSpider 2D Image | (3E)-3-[(2-Bromophenyl)imino]-1,3-di(4-morpholinyl)-1-propanone | C17H22BrN3O3

(3E)-3-[(2-Bromophenyl)imino]-1,3-di(4-morpholinyl)-1-propanone

  • Molecular FormulaC17H22BrN3O3
  • Average mass396.279 Da
  • Monoisotopic mass395.084442 Da
  • ChemSpider ID21188743

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-3-[(2-Bromophenyl)imino]-1,3-di(4-morpholinyl)-1-propanone [ACD/IUPAC Name]
(3E)-3-[(2-Bromophényl)imino]-1,3-di(4-morpholinyl)-1-propanone [French] [ACD/IUPAC Name]
(3E)-3-[(2-Bromphenyl)imino]-1,3-di(4-morpholinyl)-1-propanon [German] [ACD/IUPAC Name]
1-Propanone, 3-[(2-bromophenyl)imino]-1,3-di-4-morpholinyl-, (3E)- [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: 565.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.9±3.0 kJ/mol
Flash Point: 295.5±32.9 °C
Index of Refraction: 1.625
Molar Refractivity: 95.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.12
ACD/LogD (pH 5.5): 1.30
ACD/BCF (pH 5.5): 5.03
ACD/KOC (pH 5.5): 93.94
ACD/LogD (pH 7.4): 1.55
ACD/BCF (pH 7.4): 8.83
ACD/KOC (pH 7.4): 164.98
Polar Surface Area: 54 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 51.2±7.0 dyne/cm
Molar Volume: 269.8±7.0 cm3

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