Products 65199-11-3

CAS 65199-11-3 appears in our catalog under these names: Benzopyrene Impurity 1, Benzo(a)pyrene-7,8-dione. Offered by: Chemat Brand, TRC. Available pack sizes: on request, 100mg.

Benzopyrene Impurity 1
Chemat Brand
  • size: on request
  • Variants: 1
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Benzo(a)pyrene-7,8-dione
TRC
  • size: 100mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

Benzo[a]pyrene-7,8-dione is an o-quinone resulting from the formal oxidation of both of the hydroxy groups of benzo[a]pyrene-cis-7,8-dihydrodiol. Benzo[a]pyrene-7,8-dione is a metabolite of the widespread carcinogen benzo[a]pyrene. It has a role as a genotoxin and a xenobiotic metabolite. It is a member of orthoquinones and a member of pyrenes. It is functionally related to a benzo[a]pyrene-cis-7,8-dihydrodiol. It derives from a hydride of a benzo[a]pyrene.

Source: ChEBI

Identity
Molecular formulaC20H10O2
Molecular weight282.3 g/mol
IUPAC namebenzo[a]pyrene-7,8-dione
InChIKeyCRYMJHJFLJAFNU-UHFFFAOYSA-N
SMILESC1=CC2=C3C(=C1)C=CC4=C3C(=CC5=C4C=CC(=O)C5=O)C=C2

Computed by PubChem (NCBI)

Synonyms: benzo[a]pyrene-7,8-dione, Benzo(a)pyrene-7,8-dione, benzopyrene-7,8-dione, Benzo(a)pyrene-7,8-quinone, benzo[pqr]tetraphene-7,8-dione, Benzo[a]?pyrene-?7,8-dione, benzo[a]pyrene-7,8-quinone, BaP-7,8-dione, B[a]P-7,8-dione
Isomers (same molecular formula)
indeno[1,2-b]fluorene-6,12-dione C20H10O2