ChemSpider 2D Image | Methyl 5-bromo-3-(bromomethyl)-2-pyridinecarboxylate | C8H7Br2NO2

Methyl 5-bromo-3-(bromomethyl)-2-pyridinecarboxylate

  • Molecular FormulaC8H7Br2NO2
  • Average mass308.955 Da
  • Monoisotopic mass306.884338 Da
  • ChemSpider ID32682794

More details:

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

1048678-21-2 [RN]
2-Pyridinecarboxylic acid, 5-bromo-3-(bromomethyl)-, methyl ester [ACD/Index Name]
5-Bromo-3-(bromométhyl)-2-pyridinecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 5-bromo-3-(bromomethyl)-2-pyridinecarboxylate [ACD/IUPAC Name]
METHYL 5-BROMO-3-(BROMOMETHYL)PYRIDINE-2-CARBOXYLATE
Methyl-5-brom-3-(brommethyl)-2-pyridincarboxylat [German] [ACD/IUPAC Name]
methyl 5-bromo-3-(bromomethyl)picolinate
MFCD18251169

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

    Density: 1.9±0.1 g/cm3
    Boiling Point: 392.2±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.2±3.0 kJ/mol
    Flash Point: 191.0±27.9 °C
    Index of Refraction: 1.595
    Molar Refractivity: 56.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.21
    ACD/LogD (pH 5.5): 2.45
    ACD/BCF (pH 5.5): 42.92
    ACD/KOC (pH 5.5): 513.22
    ACD/LogD (pH 7.4): 2.45
    ACD/BCF (pH 7.4): 42.92
    ACD/KOC (pH 7.4): 513.22
    Polar Surface Area: 39 Å2
    Polarizability: 22.4±0.5 10-24cm3
    Surface Tension: 51.7±3.0 dyne/cm
    Molar Volume: 166.2±3.0 cm3

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