ChemSpider 2D Image | 5-{[(2-Bromo-2-propen-1-yl)carbamoyl]amino}pentanoic acid | C9H15BrN2O3

5-{[(2-Bromo-2-propen-1-yl)carbamoyl]amino}pentanoic acid

  • Molecular FormulaC9H15BrN2O3
  • Average mass279.131 Da
  • Monoisotopic mass278.026611 Da
  • ChemSpider ID42417415

More details:

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

5-{[(2-Brom-2-propen-1-yl)carbamoyl]amino}pentansäure [German] [ACD/IUPAC Name]
5-{[(2-Bromo-2-propen-1-yl)carbamoyl]amino}pentanoic acid [ACD/IUPAC Name]
Acide 5-{[(2-bromo-2-propén-1-yl)carbamoyl]amino}pentanoïque [French] [ACD/IUPAC Name]
Pentanoic acid, 5-[[[(2-bromo-2-propen-1-yl)amino]carbonyl]amino]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 490.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 82.8±6.0 kJ/mol
Flash Point: 250.1±27.3 °C
Index of Refraction: 1.527
Molar Refractivity: 59.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.34
ACD/LogD (pH 5.5): 0.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.38
ACD/LogD (pH 7.4): -1.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 78 Å2
Polarizability: 23.7±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 194.6±3.0 cm3

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