CAS 3067-12-7

Benzo[a]pyrene-6,12-dione

Description:

Benzo[a]pyrene-6,12-dione is a polycyclic aromatic hydrocarbon (PAH) derivative characterized by its fused ring structure, which includes a dione functional group at the 6 and 12 positions. This compound is known for its potential mutagenic and carcinogenic properties, as it is a derivative of benzo[a]pyrene, a well-studied environmental pollutant. The presence of the dione functional groups contributes to its reactivity, making it capable of participating in various chemical reactions, including oxidation and reduction processes. Benzo[a]pyrene-6,12-dione is typically found in combustion products and is of interest in environmental chemistry due to its persistence and bioaccumulation potential. Its molecular structure influences its solubility and interaction with biological systems, raising concerns regarding its impact on human health and ecosystems. As with many PAHs, it is important to handle this compound with care, considering its toxicological implications and regulatory status in various jurisdictions.

Formula: C₂₀H₁₀O₂

InChI: InChI=1S/C20H10O2/c21-17-10-16-12-5-1-2-6-13(12)20(22)15-9-8-11-4-3-7-14(17)18(11)19(15)16/h1-10H

InChI key: InChIKey=HSJQJGAVYCLWJA-UHFFFAOYSA-N

SMILES: O=C1C2=C3C=4C(C(=O)C=C3C=5C1=CC=CC5)=CC=CC4C=C2

Synonyms:

• 6,12-Dihydrobenzo[a]pyrene-6,12-dione
• Benzo[A]Pyrene-6,12-Dione
• Benzo[a]pyrene-6,12-quinone
• Benzo[def]chrysene-6,12-dione
• NSC 625589
• Benzo[pqr]tetraphene-6,12-dione

Benzopyrene Impurity 4 (Benzo[a]pyrene-6, 12-Quinone)

CAS: 3067-12-7

Formula: C₂₀H₁₀O₂

Molecular weight: 282.30

Ref: 4Z-B-526

Benzo[a]pyrene-6,12-quinone

Controlled Product

CAS: 3067-12-7

Applications Benzo[a]pyrene-6,12-quinone is a polycyclic aromatic hydrocarbon (PAH) and metabolite of Benzopyrene (B205800) that can have toxic effects on fish bone metabolism. In utero exposure to Benzo[a]pyrene-6,12-quinone can also predispose offspring to cardiovascular dysfunction in later life.
References Hayakawa, K., et al.: WIT Trans. Ecol. Envir., 135, 231 (2010); Jules, G.E., et al.: Toxicology, 295, 56 (2012)

Formula: C₂₀H₁₀O₂

Color and Shape: Neat

Molecular weight: 282.292

Ref: TR-B205870

Benzo[A]pyrene-6,12-quinone

CAS: 3067-12-7

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Formula: C₂₀H₁₀O₂

Purity: Min. 95%

Molecular weight: 282.3 g/mol

Ref: 3D-DAA06712