ChemSpider 2D Image | (2Z)-1,3-Bis(3-bromophenyl)-2-buten-1-one | C16H12Br2O

(2Z)-1,3-Bis(3-bromophenyl)-2-buten-1-one

  • Molecular FormulaC16H12Br2O
  • Average mass380.074 Da
  • Monoisotopic mass377.925476 Da
  • ChemSpider ID57581843

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-1,3-Bis(3-bromophenyl)-2-buten-1-one [ACD/IUPAC Name]
(2Z)-1,3-Bis(3-bromophényl)-2-butén-1-one [French] [ACD/IUPAC Name]
(2Z)-1,3-Bis(3-bromphenyl)-2-buten-1-on [German] [ACD/IUPAC Name]
2-Buten-1-one, 1,3-bis(3-bromophenyl)-, (2Z)- [ACD/Index Name]
1,3-Bis(3-bromophenyl)but-2-en-1-one
391897-60-2 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 450.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.9±3.0 kJ/mol
Flash Point: 118.1±15.3 °C
Index of Refraction: 1.627
Molar Refractivity: 85.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.37
ACD/LogD (pH 5.5): 5.73
ACD/BCF (pH 5.5): 13226.45
ACD/KOC (pH 5.5): 31025.40
ACD/LogD (pH 7.4): 5.73
ACD/BCF (pH 7.4): 13226.45
ACD/KOC (pH 7.4): 31025.40
Polar Surface Area: 17 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 242.1±3.0 cm3

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