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    Pinacolone

    1. Molecular Structure

    Pinacolone 2D Structure

    2. Chemical Identity

    PropertyValue
    IUPAC Name3,3-dimethylbutan-2-one
    Molecular FormulaC6H12O
    SMILESCC(=O)C(C)(C)C

    3. Chemical Properties

    PropertyValue
    Molecular Weight100.16 g/mol
    TPSA17.1 Ų
    LogP1.2
    Formal Charge0

    4. Experimental Properties

    PropertyValue
    Boiling Point106.1 °C
    Melting Point-52.5 °C
    Density0.7229 at 25 °C/25 °C
    SolubilitySol in water (2.44% at 15 °C); soluble in alcohol, ether, acetone
    Flash Point23 °C
    Autoignition TempNo data available

    5. Supplier Suggestions

    SupplierWebsiteLocation
    Sigma Aldrich/MerckVisit MerckInternational
    LennoxVisit LennoxIreland
    Doc SolderVisit Doc SolderIreland

    6. GHS Safety & Hazards

    Signal Word
    Danger
    GHS PictogramGHS Pictogram

    Hazard Statements

    • H225 (68.6%): Highly Flammable liquid and vapor [Danger Flammable liquids]
    • H225: Highly Flammable liquid and vapor [Danger Flammable liquids]
    • H302 (95.6%): Harmful if swallowed [Warning Acute toxicity, oral]
    • H319 (27%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
    • H332 (54%): Harmful if inhaled [Warning Acute toxicity, inhalation]
    • H335 (45.3%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
    • H412 (38%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

    Precautionary Statements

    • P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P330, P337+P317, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
    • P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
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