ChemSpider 2D Image | 1-Bromo-4,5,6,7-tetrahydrothieno[3,4-c]pyridine | C7H8BrNS

1-Bromo-4,5,6,7-tetrahydrothieno[3,4-c]pyridine

  • Molecular FormulaC7H8BrNS
  • Average mass218.114 Da
  • Monoisotopic mass216.956070 Da
  • ChemSpider ID21885582

More details:

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

1219531-56-2 [RN]
1-Brom-4,5,6,7-tetrahydrothieno[3,4-c]pyridin [German] [ACD/IUPAC Name]
1-Bromo-4,5,6,7-tetrahydrothieno[3,4-c]pyridine [ACD/IUPAC Name]
1-Bromo-4,5,6,7-tétrahydrothiéno[3,4-c]pyridine [French] [ACD/IUPAC Name]
Thieno[3,4-c]pyridine, 1-bromo-4,5,6,7-tetrahydro- [ACD/Index Name]
[1219531-56-2] [RN]
MFCD17215801 [MDL number]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 297.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.7±3.0 kJ/mol
Flash Point: 133.6±27.3 °C
Index of Refraction: 1.610
Molar Refractivity: 47.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.93
ACD/LogD (pH 5.5): -0.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.27
ACD/BCF (pH 7.4): 2.85
ACD/KOC (pH 7.4): 34.29
Polar Surface Area: 40 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 138.0±3.0 cm3

Click to predict properties on the Chemicalize site


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