ChemSpider 2D Image | (2Z)-1-(3-Bromo-2-thienyl)-3-(2,5-dimethoxyphenyl)-2-propen-1-one | C15H13BrO3S

(2Z)-1-(3-Bromo-2-thienyl)-3-(2,5-dimethoxyphenyl)-2-propen-1-one

  • Molecular FormulaC15H13BrO3S
  • Average mass353.231 Da
  • Monoisotopic mass351.976868 Da
  • ChemSpider ID30655035

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-1-(3-Brom-2-thienyl)-3-(2,5-dimethoxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2Z)-1-(3-Bromo-2-thienyl)-3-(2,5-dimethoxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2Z)-1-(3-Bromo-2-thiényl)-3-(2,5-diméthoxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-(3-bromo-2-thienyl)-3-(2,5-dimethoxyphenyl)-, (2Z)- [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: 483.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 246.4±28.7 °C
Index of Refraction: 1.629
Molar Refractivity: 86.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.95
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 304.02
ACD/KOC (pH 5.5): 2083.85
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 304.02
ACD/KOC (pH 7.4): 2083.85
Polar Surface Area: 64 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 243.5±3.0 cm3

Click to predict properties on the Chemicalize site


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