ChemSpider 2D Image | 2-Bromo-5,6,7,8-tetrahydro-4H-thieno[3,2-c]azepin-4-one | C8H8BrNOS

2-Bromo-5,6,7,8-tetrahydro-4H-thieno[3,2-c]azepin-4-one

  • Molecular FormulaC8H8BrNOS
  • Average mass246.124 Da
  • Monoisotopic mass244.950989 Da
  • ChemSpider ID45650393

More details:

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

2-Brom-5,6,7,8-tetrahydro-4H-thieno[3,2-c]azepin-4-on [German] [ACD/IUPAC Name]
2-Bromo-5,6,7,8-tetrahydro-4H-thieno[3,2-c]azepin-4-one [ACD/IUPAC Name]
2-Bromo-5,6,7,8-tétrahydro-4H-thiéno[3,2-c]azépin-4-one [French] [ACD/IUPAC Name]
4H-Thieno[3,2-c]azepin-4-one, 2-bromo-5,6,7,8-tetrahydro- [ACD/Index Name]
2-bromo-4H,5H,6H,7H,8H-thieno[3,2-c]azepin-4-one
2-Bromo-5,6,7,8-tetrahydrothieno[3,2-c]azepin-4-one
92336-11-3 [RN]
MFCD19687404

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

Density: 1.6±0.1 g/cm3
Boiling Point: 469.6±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: 1.607
Molar Refractivity: 52.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 23.50
ACD/KOC (pH 5.5): 333.44
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 23.50
ACD/KOC (pH 7.4): 333.44
Polar Surface Area: 57 Å2
Polarizability: 20.8±0.5 10-24cm3
Surface Tension: 48.7±3.0 dyne/cm
Molar Volume: 152.2±3.0 cm3

Click to predict properties on the Chemicalize site


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