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    • Allyl Acetate

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    Catalog Number
    ACM591877-1
    CAS Number
    591-87-7
    Product Name
    Allyl Acetate
    Structure
    Category
    Monomers
    Description
    Allyl acetate appears as a liquid. Insoluble in water and slightly less dense than water. Hence floats on water. Poisonous by ingestion and moderately toxic by inhalation and skin contact. Irritating to skin and eyes.
    IUPAC Name
    prop-2-enyl acetate
    Molecular Weight
    100.12g/mol
    Molecular Formula
    C5H8O2
    Canonical SMILES
    CC(=O)OCC=C
    InChI
    InChI=1S/C5H8O2/c1-3-4-7-5(2)6/h3H,1,4H2,2H3
    InChI Key
    FWZUNOYOVVKUNF-UHFFFAOYSA-N
    Boiling Point
    103.5 °C;103.5 °C
    Melting Point
    Freezing point: -96 °C
    Flash Point
    72 °F (NFPA, 2010)
    Density
    0.9275 g/cu cm at 20 °C
    Solubility
    0.28 M;Soluble in acetone; miscible in ethanol and ethyl ether.;2.8% in water at 20 °C
    Color/Form
    COLORLESS LIQUID
    Complexity
    76.1
    Covalently-Bonded Unit Count
    1
    EC Number
    209-734-8
    Exact Mass
    100.052429g/mol
    Formal Charge
    0
    Heavy Atom Count
    7
    Log P
    0.97 (LogP);log Kow = 0.97
    MeSH Entry Terms
    allyl acetate
    Monoisotopic Mass
    100.052429g/mol
    NSC Number
    7612
    Odor
    ACRID AT HIGH LEVELS
    Other Experimental
    CONVERSION FACTORS: 1 MG/L IS EQUIVALENT TO 245 PPM;CONVERSION FACTORS (WT/VOL): 4.14 MG/CU M IS EQUIVALENT TO 1 PPM
    Refractive Index
    INDEX OF REFRACTION: 1.4049 AT 20 °C/D
    Rotatable Bond Count
    3
    RTECS Number
    AF1750000
    UNII
    E4U5E5990I
    UN Number
    2333;2333;2333
    Vapor Density
    3.45 (AIR= 1)
    Vapor Pressure
    27.20 mmHg;27.2 mm Hg at 20 °C /from experimentally-derived coefficients/
    Viscosity
    0.52 cP at 20 °C
    XLogP3
    1
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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