ChemSpider 2D Image | (2E)-1-(5-Bromo-2-thienyl)-3-(2,3,4-trimethoxyphenyl)-2-propen-1-one | C16H15BrO4S

(2E)-1-(5-Bromo-2-thienyl)-3-(2,3,4-trimethoxyphenyl)-2-propen-1-one

  • Molecular FormulaC16H15BrO4S
  • Average mass383.257 Da
  • Monoisotopic mass381.987427 Da
  • ChemSpider ID30657375

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1-(5-Brom-2-thienyl)-3-(2,3,4-trimethoxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-(5-Bromo-2-thienyl)-3-(2,3,4-trimethoxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-(5-Bromo-2-thiényl)-3-(2,3,4-triméthoxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-(5-bromo-2-thienyl)-3-(2,3,4-trimethoxyphenyl)-, (2E)- [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: 495.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 253.6±28.7 °C
Index of Refraction: 1.614
Molar Refractivity: 93.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.29
ACD/LogD (pH 5.5): 3.81
ACD/BCF (pH 5.5): 458.87
ACD/KOC (pH 5.5): 2797.96
ACD/LogD (pH 7.4): 3.81
ACD/BCF (pH 7.4): 458.87
ACD/KOC (pH 7.4): 2797.96
Polar Surface Area: 73 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 267.5±3.0 cm3

Click to predict properties on the Chemicalize site


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