Phenanthrene

GPTKB entity

Statements (35)
Predicate Object
gptkbp:instanceOf gptkb:chemical_compound
Polycyclic aromatic hydrocarbon
gptkbp:appearance Colorless crystal
gptkbp:aroma Mild, aromatic
gptkbp:boilingPoint 340 °C
gptkbp:CASNumber 85-01-8
gptkbp:category Aromatic hydrocarbons
Environmental pollutants
gptkbp:chemicalFormula C14H10
gptkbp:density 1.179 g/cm³
gptkbp:foundIn Coal tar
gptkbp:hasInChIKey YNPNZTXNASCQKK-UHFFFAOYSA-N
gptkbp:hasSMILES c1ccc2c(c1)ccc3c2cccc3
https://www.w3.org/2000/01/rdf-schema#label Phenanthrene
gptkbp:isomerOf gptkb:Anthracene
gptkbp:IUPACName gptkb:Phenanthrene
gptkbp:KEGGID C06534
gptkbp:meltingPoint 99 °C
gptkbp:molecularWeight 178.23 g/mol
gptkbp:PubChem_CID gptkb:CHEMBL14237
995
CHEBI:28851
gptkbp:relatedTo gptkb:Naphthalene
gptkb:Pyrene
gptkbp:riskFactor Possible carcinogen
gptkbp:solubility Insoluble
gptkbp:solubilityInBenzene Soluble
gptkbp:solubilityInEther Soluble
gptkbp:structureType Three fused benzene rings
gptkbp:UNII U1J390A5Y7
gptkbp:uses Dye production
Pharmaceuticals
Pesticide production
gptkbp:bfsParent gptkb:Naphthalene
gptkbp:bfsLayer 7