Benzo[ghi]perylene
Synonyms: Benzo[ghi]perylene, "1,12-Benzoperylene", "1,12-Benzperylene", "Benzo(g,h,i)perylene", "Benzo[g,h,i]perylene", "Benzo(ghi)pyrilene", "Benzo-1,12-perylene"
Source: Benzo[ghi]perylene is a product of incomplete combustion.
Identifiers:
IUPAC Name: hexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene
CAS Number: 191-24-2
PubChem ID: 9117
InChiKey: GYFAGKUZYNFMBN-UHFFFAOYSA-N
Canonical SMILES: C1=CC2=C3C(=C1)C4=CC=CC5=C4C6=C(C=C5)C=CC(=C36)C=C2
Structural Properties:
Molecular Formula: C22H12
Molecular Weight: 276,300
Pharmacophore Features:
Number of bond donors: 0
Number of bond acceptors: 0
Number of atoms different from hydrogen: 22
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3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)
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Evidence Supporting This Chemical as an Emerging Contaminant
Mailler, R., Gasperi, J., Patureau, D., Vulliet, E., Delgenes, N., Danel, A., ... & Chebbo, G. (2017). Fate of emerging and priority micropollutants during the sewage sludge treatment: Case study of Paris conurbation. Part 1: Contamination of the different types of sewage sludge. Waste management, 59, 379-393.