Found 78 results

Search term: MF = 'C_{13}H_{7}BrOS'
ChemSpider 2D Image | 4-Bromo-3-(2-thienylethynyl)benzaldehyde | C13H7BrOS

4-Bromo-3-(2-thienylethynyl)benzaldehyde

  • Molecular FormulaC13H7BrOS
  • Average mass291.163 Da
  • Monoisotopic mass289.940094 Da
  • ChemSpider ID96036987

More details:

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

4-Brom-3-(2-thienylethinyl)benzaldehyd [German] [ACD/IUPAC Name]
4-Bromo-3-(2-thienylethynyl)benzaldehyde [ACD/IUPAC Name]
4-Bromo-3-(2-thiényléthynyl)benzaldéhyde [French] [ACD/IUPAC Name]
Benzaldehyde, 4-bromo-3-[2-(2-thienyl)ethynyl]- [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: 432.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.8±3.0 kJ/mol
Flash Point: 215.2±28.7 °C
Index of Refraction: 1.686
Molar Refractivity: 69.6±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.81
ACD/LogD (pH 5.5): 4.35
ACD/BCF (pH 5.5): 1184.61
ACD/KOC (pH 5.5): 5516.50
ACD/LogD (pH 7.4): 4.35
ACD/BCF (pH 7.4): 1184.61
ACD/KOC (pH 7.4): 5516.50
Polar Surface Area: 45 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 64.5±5.0 dyne/cm
Molar Volume: 182.8±5.0 cm3

Click to predict properties on the Chemicalize site


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