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CAS 3067-13-8

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Benzo[a]pyrene-1,6-dione

Description:
Benzo[a]pyrene-1,6-dione is a polycyclic aromatic compound characterized by its fused ring structure, which includes a dione functional group. This compound is derived from benzo[a]pyrene, a well-known carcinogen, and exhibits significant chemical reactivity due to the presence of the carbonyl groups. It is typically a solid at room temperature and is insoluble in water but soluble in organic solvents. The presence of the dione functional groups contributes to its potential as an electrophile, making it reactive in various chemical reactions, including nucleophilic additions. Benzo[a]pyrene-1,6-dione is of interest in environmental chemistry due to its formation from the degradation of polycyclic aromatic hydrocarbons (PAHs) and its implications in toxicology and carcinogenesis. Its study is crucial for understanding the mechanisms of PAH-related health risks and environmental persistence. Additionally, it may serve as a precursor or intermediate in synthetic organic chemistry, particularly in the development of more complex molecular architectures.
Formula:C20H10O2
InChI:InChI=1S/C20H10O2/c21-17-10-6-11-5-7-16-19-13(8-9-15(17)18(11)19)12-3-1-2-4-14(12)20(16)22/h1-10H
InChI key:InChIKey=OXWHZARNAGLRFL-UHFFFAOYSA-N
SMILES:O=C1C=2C3=C4C(=CC=C3C=5C1=CC=CC5)C(=O)C=CC4=CC2
Synonyms:
  • 1,6-Dihydrobenzo[a]pyrene-1,6-dione
  • Benzo[A]Pyrene-1,6-Dione
  • Benzo[a]pyrene-1,6-quinone
  • NSC 30985
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Found 2 products.
  • Benzo[a]pyrene-1,6-dione
    Indagoo
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    Benzo[a]pyrene-1,6-dione

    CAS:
    Formula:C20H10O2
    Color and Shape:Solid
    Molecular weight:282.2922

    Ref: IN-DA0030SF

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  • Benzo[a]pyrene-1,6-quinone
    TRC
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    Benzo[a]pyrene-1,6-quinone

    Controlled Product
    CAS:
    <p>Applications Benzo[a]pyrene-1,6-quinone is a metabolite of Benzopyrene (B205800) and is able to induce epidermal growth factor receptor (EGFR) cell signaling in human mammary epithelial cells. Also highly mutagenic and carcinogenic.<br>References Rodriguez-Fragoso, L., et al.: Toxicol. Appl. Pharm., 235, 321 (2009); Sen, S., et al.: Chem. Res. Toxicol., 25, 2117 (2012)<br></p>
    Formula:C20H10O2
    Color and Shape:Neat
    Molecular weight:282.29

    Ref: TR-B205860

    10mg
    354.00€
    100mg
    2,320.00€