Found 75 results

Search term: MF = 'C_{14}H_{9}BrO_{2}S'
ChemSpider 2D Image | 3-[(4-Bromo-2-thienyl)methylene]-2,3-dihydro-4H-chromen-4-one | C14H9BrO2S

3-[(4-Bromo-2-thienyl)methylene]-2,3-dihydro-4H-chromen-4-one

  • Molecular FormulaC14H9BrO2S
  • Average mass321.189 Da
  • Monoisotopic mass319.950653 Da
  • ChemSpider ID35421187

More details:

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

3-[(4-Brom-2-thienyl)methylen]-2,3-dihydro-4H-chromen-4-on [German] [ACD/IUPAC Name]
3-[(4-Bromo-2-thienyl)methylene]-2,3-dihydro-4H-chromen-4-one [ACD/IUPAC Name]
3-[(4-Bromo-2-thiényl)méthylène]-2,3-dihydro-4H-chromén-4-one [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-[(4-bromo-2-thienyl)methylene]-2,3-dihydro- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 469.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 237.8±28.7 °C
Index of Refraction: 1.708
Molar Refractivity: 76.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.70
ACD/LogD (pH 5.5): 4.25
ACD/BCF (pH 5.5): 1003.45
ACD/KOC (pH 5.5): 4898.60
ACD/LogD (pH 7.4): 4.25
ACD/BCF (pH 7.4): 1003.45
ACD/KOC (pH 7.4): 4898.60
Polar Surface Area: 55 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 61.2±3.0 dyne/cm
Molar Volume: 197.3±3.0 cm3

Click to predict properties on the Chemicalize site


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