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  • 7-Methylbenz[a]anthracene

    • 7-Methylbenz[a]anthracene

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    Catalog Number
    ACM2541697
    CAS Number
    2541-69-7
    Product Name
    7-Methylbenz[a]anthracene
    Structure
    Category
    Electroluminescence Materials
    Synonyms
    10-Methyl-1,2-benzanthracen;10-Methyl-1,2-benzanthracene;3,4-benz-9-methylanthracene;7-MBA;7-methyl-benz(a)anthracen;7-methylbenzanthracene;7-Methylbenzo[a]anthracene;7-METHYLBENZ[A]ANTHRACENE
    IUPAC Name
    7-methylbenzo[a]anthracene
    Molecular Weight
    242.3g/mol
    Molecular Formula
    C19H14
    Canonical SMILES
    CC1=C2C=CC3=CC=CC=C3C2=CC4=CC=CC=C14
    InChI
    InChI=1S/C19H14/c1-13-16-8-4-3-7-15(16)12-19-17(13)11-10-14-6-2-5-9-18(14)19/h2-12H,1H3
    InChI Key
    DIIFUCUPDHMNIV-UHFFFAOYSA-N
    Melting Point
    141.0 °C;141 °C
    Solubility
    4.54e-08 M;In water, 1.1X10-2 mg/L at 24 °C;Insoluble in water;Soluble in ethanol, ethyl ether, acetone, carbon tetrachloride, carbon disulfide, xylene
    Color/Form
    Yellow plates from alcohol
    Complexity
    320
    Covalently-Bonded Unit Count
    1
    EC Number
    219-819-1
    Exact Mass
    242.10955g/mol
    Formal Charge
    0
    Heavy Atom Count
    19
    Log P
    log Kow = 6.07 (est)
    MeSH Entry Terms
    7-methylbenz(a)anthracene;7-methylbenzanthracene
    Monoisotopic Mass
    242.10955g/mol
    NSC Number
    30974
    Other Experimental
    Henry's Law constant = 1.90X10-6 atm-cu m/mol at 25 °C (est);Hydroxyl radical reaction rate constant = 1.31X10-10 cu cm/molec-sec at 25 °C (est)
    Rotatable Bond Count
    0
    Stability
    Stable under recommended storage conditions.[Sigma-Aldrich; Safety Data Sheet for 7-Methylbenz
    UNII
    F0662CQU1Q
    Vapor Pressure
    3.06X10-7 mm Hg at 25 °C (est)
    XLogP3
    6.3
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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