ChemSpider 2D Image | 3-Bromo-7-chloro-1-benzothiophene-5-carbaldehyde | C9H4BrClOS

3-Bromo-7-chloro-1-benzothiophene-5-carbaldehyde

  • Molecular FormulaC9H4BrClOS
  • Average mass275.549 Da
  • Monoisotopic mass273.885468 Da
  • ChemSpider ID61074042

More details:

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

3-Brom-7-chlor-1-benzothiophen-5-carbaldehyd [German] [ACD/IUPAC Name]
3-Bromo-7-chloro-1-benzothiophene-5-carbaldehyde [ACD/IUPAC Name]
3-Bromo-7-chloro-1-benzothiophène-5-carbaldéhyde [French] [ACD/IUPAC Name]
Benzo[b]thiophene-5-carboxaldehyde, 3-bromo-7-chloro- [ACD/Index Name]
1935050-96-6 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 386.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.6±3.0 kJ/mol
Flash Point: 187.6±26.5 °C
Index of Refraction: 1.743
Molar Refractivity: 61.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.19
ACD/LogD (pH 5.5): 4.18
ACD/BCF (pH 5.5): 880.85
ACD/KOC (pH 5.5): 4462.34
ACD/LogD (pH 7.4): 4.18
ACD/BCF (pH 7.4): 880.85
ACD/KOC (pH 7.4): 4462.34
Polar Surface Area: 45 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 60.2±3.0 dyne/cm
Molar Volume: 152.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement