benz[a]acridine

Synonyms: "benz[a]acridine", "benzo(a)acridine", "benzacridine", "benzo[a]acridine", "1,2-benzacridine", "7-azabenz(a)anthracene".

Source: Benz[a]acridine is present as a minor component of the total content of polynuclear aromatic compounds in the environment. Human exposure to benz[a]acridine occurs primarily through inhalation of polluted air and by ingestion of food and water contaminated with combustion products.

Identifiers:

IUPAC Name: benzo[a]acridine
CAS Number: 225-11-6
PubChem ID: 9180
InChiKey: JEGZRTMZYUDVBF-UHFFFAOYSA-N
Canonical SMILES: C1=CC=C2C(=C1)C=CC3=NC4=CC=CC=C4C=C32

Structural Properties:

Molecular Formula: C₁₇H₁₁N
Molecular Weight: 229.282

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 1
Number of atoms different from hydrogen: 18

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Evidence Supporting This Chemical as an Endocrine Disruptor
TEDX List of Potential Endocrine Disruptors

Benisek M, Blaha L, Hilscherova K. 2008. Interference of PAHs and their N-heterocyclic analogs with signaling of retinoids in vitro. Toxicol in Vitro 22(8):1909-1917. DOI: 10.1016/j.tiv.2008.09.009. URL: http://www.sciencedirect.com/science/article/pii/S0887233308002373?via%3Dihub.