coronene

GPTKB entity

Statements (34)
Predicate Object
gptkbp:instanceOf polycyclic aromatic hydrocarbon
gptkbp:appearance yellow crystals
gptkbp:aroma odorless
gptkbp:CASNumber 191-07-1
gptkbp:category polycyclic compound
PAH pollutant
aromatic hydrocarbon
gptkbp:chemicalFormula gptkb:C24H12
gptkbp:color yellow
gptkbp:crystalSystem monoclinic
gptkbp:density 1.38 g/cm³
gptkbp:discoveredBy gptkb:Carl_Gräbe
gptkbp:discoveredIn 1871
gptkbp:hasInChIKey JYAMJOBYJHVZLM-UHFFFAOYSA-N
gptkbp:hasSMILES c1ccc2c3c4c5c1cccc5ccc6cccc2c6c3c4
https://www.w3.org/2000/01/rdf-schema#label coronene
gptkbp:IUPACName gptkb:coronene
gptkbp:meltingPoint 438 °C
gptkbp:molecularWeight 300.36 g/mol
gptkbp:numberOfRooms 7
gptkbp:PubChem_CID 8799
9150
CHEBI:36612
CHEMBL318383
gptkbp:riskFactor H351 (suspected of causing cancer)
gptkbp:solubility insoluble
gptkbp:solubilityInBenzene soluble
gptkbp:structure planar
gptkbp:symmetry P21/a
gptkbp:UNII 1A1VQ4E8F6
gptkbp:uses fluorescent probe
model compound for graphene
gptkbp:bfsParent gptkb:hexabenzocoronene
gptkbp:bfsLayer 6