|
gptkbp:instanceOf
|
heterocyclic compound
|
|
gptkbp:appearance
|
colorless, flammable liquid
|
|
gptkbp:aroma
|
ether-like
|
|
gptkbp:autoignitionTemperature
|
315 °C
|
|
gptkbp:boilingPoint
|
31.4 °C
|
|
gptkbp:CASNumber
|
110-00-9
|
|
gptkbp:category
|
aromatic compounds
solvents
oxygen heterocycles
|
|
gptkbp:chemicalFormula
|
C4H4O
|
|
gptkbp:density
|
0.936 g/cm³
|
|
gptkbp:discoveredBy
|
gptkb:Heinrich_Limpricht
|
|
gptkbp:discoveredIn
|
1870
|
|
gptkbp:EC_number
|
203-727-3
|
|
gptkbp:flammability
|
highly flammable
|
|
gptkbp:flashPoint
|
-35 °C
|
|
gptkbp:foundIn
|
heat-treated foods
|
|
gptkbp:Gmelin_Reference
|
1041
|
|
gptkbp:hasInChIKey
|
InChI=1S/C4H4O/c1-2-4-5-3-1/h1-4H
|
|
gptkbp:hasLogP
|
1.42
|
|
gptkbp:hasSMILES
|
c1ccoc1
|
|
gptkbp:hazard_statement
|
H226 (flammable liquid and vapor)
H351 (suspected of causing cancer)
|
|
https://www.w3.org/2000/01/rdf-schema#label
|
furan
|
|
gptkbp:IUPACName
|
gptkb:furan
|
|
gptkbp:KEGGID
|
C06585
|
|
gptkbp:meltingPoint
|
-85.6 °C
|
|
gptkbp:MeSH_ID
|
gptkb:D005669
|
|
gptkbp:molecularWeight
|
68.07 g/mol
|
|
gptkbp:NFPA704
|
Health 2, Flammability 4, Instability 1
|
|
gptkbp:odor_threshold
|
0.04 ppm
|
|
gptkbp:PubChem_CID
|
gptkb:CHEBI:35594
CHEMBL1377
8026
|
|
gptkbp:refractiveIndex
|
1.433 (20 °C)
|
|
gptkbp:relatedTo
|
gptkb:benzofuran
gptkb:pyrrole
gptkb:thiophene
|
|
gptkbp:riskFactor
|
possible carcinogen
toxic, flammable, possible carcinogen
|
|
gptkbp:solubility
|
slightly soluble
|
|
gptkbp:structure
|
five-membered aromatic ring with four carbons and one oxygen
|
|
gptkbp:UNNumber
|
2389
|
|
gptkbp:uses
|
solvent
pharmaceutical synthesis
precursor to other chemicals
|
|
gptkbp:vapor_density
|
2.3 (air = 1)
|
|
gptkbp:vaporPressure
|
440 mmHg (20 °C)
|
|
gptkbp:bfsParent
|
gptkb:Furan
|
|
gptkbp:bfsLayer
|
6
|