ChemSpider 2D Image | 1-[(4,5-Dibromo-2-thienyl)carbonyl]-N,N-dimethyl-2-piperazinecarboxamide | C12H15Br2N3O2S

1-[(4,5-Dibromo-2-thienyl)carbonyl]-N,N-dimethyl-2-piperazinecarboxamide

  • Molecular FormulaC12H15Br2N3O2S
  • Average mass425.139 Da
  • Monoisotopic mass422.925171 Da
  • ChemSpider ID35951057

More details:

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

1-[(4,5-Dibrom-2-thienyl)carbonyl]-N,N-dimethyl-2-piperazincarboxamid [German] [ACD/IUPAC Name]
1-[(4,5-Dibromo-2-thienyl)carbonyl]-N,N-dimethyl-2-piperazinecarboxamide [ACD/IUPAC Name]
1-[(4,5-Dibromo-2-thiényl)carbonyl]-N,N-diméthyl-2-pipérazinecarboxamide [French] [ACD/IUPAC Name]
2-Piperazinecarboxamide, 1-[(4,5-dibromo-2-thienyl)carbonyl]-N,N-dimethyl- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 559.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.2±3.0 kJ/mol
Flash Point: 292.1±30.1 °C
Index of Refraction: 1.615
Molar Refractivity: 86.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.27
ACD/LogD (pH 5.5): 0.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.48
ACD/LogD (pH 7.4): 1.49
ACD/BCF (pH 7.4): 7.34
ACD/KOC (pH 7.4): 130.94
Polar Surface Area: 81 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 247.4±3.0 cm3

Click to predict properties on the Chemicalize site


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