ChemSpider 2D Image | methyl 5-(dibromomethyl)picolinate | C8H7Br2NO2

methyl 5-(dibromomethyl)picolinate

  • Molecular FormulaC8H7Br2NO2
  • Average mass308.955 Da
  • Monoisotopic mass306.884338 Da
  • ChemSpider ID14393677

More details:

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

2-Pyridinecarboxylic acid, 5-(dibromomethyl)-, methyl ester [ACD/Index Name]
5-(Dibromométhyl)-2-pyridinecarboxylate de méthyle [French] [ACD/IUPAC Name]
55876-83-0 [RN]
Methyl 5-(dibromomethyl)-2-pyridinecarboxylate [ACD/IUPAC Name]
methyl 5-(dibromomethyl)picolinate
Methyl 5-(dibromomethyl)pyridine-2-carboxylate
Methyl-5-(dibrommethyl)-2-pyridincarboxylat [German] [ACD/IUPAC Name]
DS-9202
methyl5-(dibromomethyl)picolinate
MFCD11040649 [MDL number]

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

    Density: 1.9±0.1 g/cm3
    Boiling Point: 374.1±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.1±3.0 kJ/mol
    Flash Point: 180.1±26.5 °C
    Index of Refraction: 1.605
    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: 1.80
    ACD/LogD (pH 5.5): 2.36
    ACD/BCF (pH 5.5): 36.55
    ACD/KOC (pH 5.5): 457.41
    ACD/LogD (pH 7.4): 2.36
    ACD/BCF (pH 7.4): 36.55
    ACD/KOC (pH 7.4): 457.41
    Polar Surface Area: 39 Å2
    Polarizability: 22.4±0.5 10-24cm3
    Surface Tension: 54.7±3.0 dyne/cm
    Molar Volume: 164.0±3.0 cm3

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