ChemSpider 2D Image | 3,4-Bis[(2-pyridinylmethyl)amino]-3-cyclobutene-1,2-dione | C16H14N4O2

3,4-Bis[(2-pyridinylmethyl)amino]-3-cyclobutene-1,2-dione

  • Molecular FormulaC16H14N4O2
  • Average mass294.308 Da
  • Monoisotopic mass294.111664 Da
  • ChemSpider ID27321474

More details:

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

3,4-Bis[(2-pyridinylmethyl)amino]-3-cyclobuten-1,2-dion [German] [ACD/IUPAC Name]
3,4-Bis[(2-pyridinylmethyl)amino]-3-cyclobutene-1,2-dione [ACD/IUPAC Name]
3,4-Bis[(2-pyridinylméthyl)amino]-3-cyclobutène-1,2-dione [French] [ACD/IUPAC Name]
3-Cyclobutene-1,2-dione, 3,4-bis[(2-pyridinylmethyl)amino]- [ACD/Index Name]
3,4-bis(pyridin-2-ylmethylamino)cyclobut-3-ene-1,2-dione
3,4-bis[(pyridin-2-ylmethyl)amino]cyclobut-3-ene-1,2-dione
361521-00-8 [RN]
AGN-PC-09RHDO
AKOS005754679
MCULE-9653143356
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 497.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 76.6±3.0 kJ/mol
    Flash Point: 254.8±31.5 °C
    Index of Refraction: 1.654
    Molar Refractivity: 79.8±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: -0.75
    ACD/LogD (pH 5.5): 0.34
    ACD/BCF (pH 5.5): 1.01
    ACD/KOC (pH 5.5): 33.06
    ACD/LogD (pH 7.4): 0.43
    ACD/BCF (pH 7.4): 1.25
    ACD/KOC (pH 7.4): 40.69
    Polar Surface Area: 84 Å2
    Polarizability: 31.6±0.5 10-24cm3
    Surface Tension: 68.4±5.0 dyne/cm
    Molar Volume: 217.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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