ChemSpider 2D Image | N-(3-Bromo-5-chloro-2-pyridinyl)-N-methyl-beta-alanine | C9H10BrClN2O2

N-(3-Bromo-5-chloro-2-pyridinyl)-N-methyl-β-alanine

  • Molecular FormulaC9H10BrClN2O2
  • Average mass293.545 Da
  • Monoisotopic mass291.961395 Da
  • ChemSpider ID57947615

More details:

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

N-(3-Brom-5-chlor-2-pyridinyl)-N-methyl-β-alanin [German] [ACD/IUPAC Name]
N-(3-Bromo-5-chloro-2-pyridinyl)-N-methyl-β-alanine [ACD/IUPAC Name]
N-(3-Bromo-5-chloro-2-pyridinyl)-N-méthyl-β-alanine [French] [ACD/IUPAC Name]
β-Alanine, N-(3-bromo-5-chloro-2-pyridinyl)-N-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: 405.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 199.1±28.7 °C
Index of Refraction: 1.621
Molar Refractivity: 62.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 2.38
ACD/KOC (pH 5.5): 25.46
ACD/LogD (pH 7.4): -0.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 53 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 176.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement