ChemSpider 2D Image | (2Z)-3-(5-Bromo-2-thienyl)-1-(4-methoxyphenyl)-2-propen-1-one | C14H11BrO2S

(2Z)-3-(5-Bromo-2-thienyl)-1-(4-methoxyphenyl)-2-propen-1-one

  • Molecular FormulaC14H11BrO2S
  • Average mass323.205 Da
  • Monoisotopic mass321.966309 Da
  • ChemSpider ID21424159

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3-(5-Brom-2-thienyl)-1-(4-methoxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2Z)-3-(5-Bromo-2-thienyl)-1-(4-methoxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2Z)-3-(5-Bromo-2-thiényl)-1-(4-méthoxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
(2Z)-3-(5-Bromo-2-thienyl)-1-(4-methoxyphenyl)prop-2-en-1-one
2-Propen-1-one, 3-(5-bromo-2-thienyl)-1-(4-methoxyphenyl)-, (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: 447.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.6±3.0 kJ/mol
Flash Point: 224.4±28.7 °C
Index of Refraction: 1.648
Molar Refractivity: 79.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 850.34
ACD/KOC (pH 5.5): 4351.14
ACD/LogD (pH 7.4): 4.16
ACD/BCF (pH 7.4): 850.34
ACD/KOC (pH 7.4): 4351.14
Polar Surface Area: 55 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 219.5±3.0 cm3

Click to predict properties on the Chemicalize site


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