Benzene

URI: https://gptkb.org/entity/Benzene

GPTKB entity

Statements (64)

Predicate	Object
gptkbp:instanceOf	Aromatic hydrocarbon
gptkbp:appearance	Colorless liquid
gptkbp:aroma	Sweet aromatic odor
gptkbp:aromaticity	Aromatic
gptkbp:band	Delocalized pi electrons
gptkbp:boilingPoint	80.1 °C
gptkbp:carcinogenicity	Known human carcinogen
gptkbp:CASNumber	71-43-2
gptkbp:chemicalFormula	C6H6
gptkbp:density	0.8765 g/cm³
gptkbp:discoveredBy	gptkb:Michael_Faraday
gptkbp:discoveredIn	1825
gptkbp:EC_number	200-753-7
gptkbp:exposureLimitNIOSH	0.1 ppm (10-hour TWA)
gptkbp:exposureLimitOSHA	1 ppm (8-hour TWA)
gptkbp:flammability	Highly flammable
gptkbp:foundIn	Crude oil Cigarette smoke Volcanic emissions
gptkbp:hasInChIKey	gptkb:UHOVQNZJYSORNB-UHFFFAOYSA-N
gptkbp:hasLogP	2.13
gptkbp:hasSMILES	c1ccccc1
https://www.w3.org/2000/01/rdf-schema#label	Benzene
gptkbp:IUPACName	gptkb:Benzene
gptkbp:KEGGID	C01407
gptkbp:meltingPoint	5.5 °C
gptkbp:MeSH_ID	gptkb:D001568
gptkbp:molecularShape	Planar
gptkbp:molecularWeight	78.11 g/mol
gptkbp:numberOfCarbons	6
gptkbp:numberOfHydrogens	6
gptkbp:pKa	43
gptkbp:productionMethod	Catalytic reforming Steam cracking Toluene hydrodealkylation
gptkbp:PubChem_CID	gptkb:CHEBI:16716 gptkb:CHEMBL277500 241
gptkbp:refractiveIndex	1.5011 (20 °C)
gptkbp:relatedTo	gptkb:Aniline gptkb:Naphthalene gptkb:Phenol gptkb:Toluene
gptkbp:ringSize	6
gptkbp:riskFactor	Carcinogen Carcinogenic, flammable, toxic H225, H304, H315, H319, H340, H350, H372, H401
gptkbp:signalWord	Danger
gptkbp:solubility	1.79 g/L (25 °C)
gptkbp:structure	Hexagonal ring
gptkbp:symmetry	D6h
gptkbp:toxicity	Toxic
gptkbp:UNNumber	1114
gptkbp:uses	Industrial solvent Precursor to detergents Precursor to drugs Precursor to dyes Precursor to pesticides Precursor to plastics Precursor to resins Precursor to synthetic fibers
gptkbp:vaporPressure	12.7 kPa (25 °C)
gptkbp:bfsParent	gptkb:Yehuda_Poliker
gptkbp:bfsLayer	5