ChemSpider 2D Image | 3-{[N-(5-Bromo-2-furoyl)glycyl]amino}-2-hydroxy-2-methylpropanoic acid | C11H13BrN2O6

3-{[N-(5-Bromo-2-furoyl)glycyl]amino}-2-hydroxy-2-methylpropanoic acid

  • Molecular FormulaC11H13BrN2O6
  • Average mass349.135 Da
  • Monoisotopic mass347.995697 Da
  • ChemSpider ID71388221

More details:

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

3-{[N-(5-Brom-2-furoyl)glycyl]amino}-2-hydroxy-2-methylpropansäure [German] [ACD/IUPAC Name]
3-{[N-(5-Bromo-2-furoyl)glycyl]amino}-2-hydroxy-2-methylpropanoic acid [ACD/IUPAC Name]
Acide 3-{[N-(5-bromo-2-furoyl)glycyl]amino}-2-hydroxy-2-méthylpropanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[[2-[[(5-bromo-2-furanyl)carbonyl]amino]acetyl]amino]-2-hydroxy-2-methyl- [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: 660.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.1±3.0 kJ/mol
Flash Point: 353.2±31.5 °C
Index of Refraction: 1.580
Molar Refractivity: 69.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.61
ACD/LogD (pH 5.5): -2.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 63.2±3.0 dyne/cm
Molar Volume: 209.4±3.0 cm3

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