ChemSpider 2D Image | (2E)-3-(4-Bromophenyl)-1-(1H-pyrrol-2-yl)-2-propen-1-one | C13H10BrNO

(2E)-3-(4-Bromophenyl)-1-(1H-pyrrol-2-yl)-2-propen-1-one

  • Molecular FormulaC13H10BrNO
  • Average mass276.129 Da
  • Monoisotopic mass274.994568 Da
  • ChemSpider ID31108581

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(4-Bromophenyl)-1-(1H-pyrrol-2-yl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-3-(4-Bromophényl)-1-(1H-pyrrol-2-yl)-2-propén-1-one [French] [ACD/IUPAC Name]
(2E)-3-(4-Bromphenyl)-1-(1H-pyrrol-2-yl)-2-propen-1-on [German] [ACD/IUPAC Name]
2-Propen-1-one, 3-(4-bromophenyl)-1-(1H-pyrrol-2-yl)-, (2E)- [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: 438.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.6±3.0 kJ/mol
Flash Point: 219.3±28.7 °C
Index of Refraction: 1.675
Molar Refractivity: 69.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.07
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 175.78
ACD/KOC (pH 5.5): 1407.86
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 175.78
ACD/KOC (pH 7.4): 1407.86
Polar Surface Area: 33 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 184.3±3.0 cm3

Click to predict properties on the Chemicalize site


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