ChemSpider 2D Image | 1-(4,6-Dichloro-5-pyrimidinyl)ethanone | C6H4Cl2N2O

1-(4,6-Dichloro-5-pyrimidinyl)ethanone

  • Molecular FormulaC6H4Cl2N2O
  • Average mass191.015 Da
  • Monoisotopic mass189.970062 Da
  • ChemSpider ID29355999

More details:

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

1-(4,6-Dichlor-5-pyrimidinyl)ethanon [German] [ACD/IUPAC Name]
1-(4,6-Dichloro-5-pyrimidinyl)ethanone [ACD/IUPAC Name]
1-(4,6-Dichloro-5-pyrimidinyl)éthanone [French] [ACD/IUPAC Name]
1-(4,6-Dichloropyrimidin-5-yl)ethanone
60025-06-1 [RN]
Ethanone, 1-(4,6-dichloro-5-pyrimidinyl)- [ACD/Index Name]
1-(4,6-dichloropyrimidin-5-yl)ethan-1-one
4,6-dichloro-5-acetylpyrimidine
5-ACETALDEHYDEYL-4,6-DICHLOROPYRIMIDINE
5-Hexene-1,2-diol, (2R)- [ACD/Index Name]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 240.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 47.7±3.0 kJ/mol
    Flash Point: 99.1±25.9 °C
    Index of Refraction: 1.557
    Molar Refractivity: 42.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.93
    ACD/LogD (pH 5.5): 0.93
    ACD/BCF (pH 5.5): 2.99
    ACD/KOC (pH 5.5): 76.32
    ACD/LogD (pH 7.4): 0.93
    ACD/BCF (pH 7.4): 2.99
    ACD/KOC (pH 7.4): 76.32
    Polar Surface Area: 43 Å2
    Polarizability: 16.8±0.5 10-24cm3
    Surface Tension: 51.9±3.0 dyne/cm
    Molar Volume: 131.3±3.0 cm3

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