ChemSpider 2D Image | 2-Ethynyl-3-methylpyridine | C8H7N

2-Ethynyl-3-methylpyridine

  • Molecular FormulaC8H7N
  • Average mass117.148 Da
  • Monoisotopic mass117.057846 Da
  • ChemSpider ID23717651

More details:

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

2-Ethinyl-3-methylpyridin [German] [ACD/IUPAC Name]
2-Ethynyl-3-methylpyridine [ACD/IUPAC Name]
2-Ethynyl-3-methyl-pyridine
2-Éthynyl-3-méthylpyridine [French] [ACD/IUPAC Name]
30413-59-3 [RN]
MFCD13175242 [MDL number]
Pyridine, 2-ethynyl-3-methyl- [ACD/Index Name]
(3-Methylpyridin-2-yl)acetylene
(3-Methylpyridin-2-yl)acetylene, 2-Ethynyl-3-picoline
(3-Methylpyridin-2-yl)acetylene; 2-Ethynyl-3-picoline
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.0±0.1 g/cm3
    Boiling Point: 202.6±28.0 °C at 760 mmHg
    Vapour Pressure: 0.4±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 42.1±3.0 kJ/mol
    Flash Point: 75.5±16.6 °C
    Index of Refraction: 1.534
    Molar Refractivity: 36.2±0.4 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.37
    ACD/LogD (pH 5.5): 1.51
    ACD/BCF (pH 5.5): 8.28
    ACD/KOC (pH 5.5): 157.93
    ACD/LogD (pH 7.4): 1.51
    ACD/BCF (pH 7.4): 8.28
    ACD/KOC (pH 7.4): 158.10
    Polar Surface Area: 13 Å2
    Polarizability: 14.4±0.5 10-24cm3
    Surface Tension: 42.2±5.0 dyne/cm
    Molar Volume: 116.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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