ChemSpider 2D Image | 4-{[(5-Bromo-2-furoyl)amino]methyl}tetrahydro-2H-pyran-4-carboxamide | C12H15BrN2O4

4-{[(5-Bromo-2-furoyl)amino]methyl}tetrahydro-2H-pyran-4-carboxamide

  • Molecular FormulaC12H15BrN2O4
  • Average mass331.163 Da
  • Monoisotopic mass330.021515 Da
  • ChemSpider ID26227716

More details:

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

2H-Pyran-4-carboxamide, 4-[[[(5-bromo-2-furanyl)carbonyl]amino]methyl]tetrahydro- [ACD/Index Name]
4-{[(5-Brom-2-furoyl)amino]methyl}tetrahydro-2H-pyran-4-carboxamid [German] [ACD/IUPAC Name]
4-{[(5-Bromo-2-furoyl)amino]methyl}tetrahydro-2H-pyran-4-carboxamide [ACD/IUPAC Name]
4-{[(5-Bromo-2-furoyl)amino]méthyl}tétrahydro-2H-pyrane-4-carboxamide [French] [ACD/IUPAC Name]
4-{[(5-BROMOFURAN-2-YL)FORMAMIDO]METHYL}OXANE-4-CARBOXAMIDE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 547.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 284.9±30.1 °C
Index of Refraction: 1.557
Molar Refractivity: 70.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.31
ACD/LogD (pH 5.5): 0.56
ACD/BCF (pH 5.5): 1.57
ACD/KOC (pH 5.5): 47.99
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.57
ACD/KOC (pH 7.4): 47.99
Polar Surface Area: 95 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 219.1±3.0 cm3

Click to predict properties on the Chemicalize site


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