ChemSpider 2D Image | 4-[(5-Bromo-3-chloro-2-pyridinyl)amino]butanoic acid | C9H10BrClN2O2

4-[(5-Bromo-3-chloro-2-pyridinyl)amino]butanoic acid

  • Molecular FormulaC9H10BrClN2O2
  • Average mass293.545 Da
  • Monoisotopic mass291.961395 Da
  • ChemSpider ID57945737

More details:

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

4-[(5-Brom-3-chlor-2-pyridinyl)amino]butansäure [German] [ACD/IUPAC Name]
4-[(5-Bromo-3-chloro-2-pyridinyl)amino]butanoic acid [ACD/IUPAC Name]
Acide 4-[(5-bromo-3-chloro-2-pyridinyl)amino]butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-[(5-bromo-3-chloro-2-pyridinyl)amino]- [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: 443.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 222.0±28.7 °C
Index of Refraction: 1.629
Molar Refractivity: 62.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 8.77
ACD/KOC (pH 5.5): 93.38
ACD/LogD (pH 7.4): 0.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.48
Polar Surface Area: 62 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 61.2±3.0 dyne/cm
Molar Volume: 174.4±3.0 cm3

Click to predict properties on the Chemicalize site


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