Anilin

GPTKB entity

Statements (54)
Predicate Object
gptkbp:instanceOf gptkb:chemical_compound
aromatic amine
gptkbp:appearance colorless to slightly yellow liquid
gptkbp:aroma amine-like
gptkbp:boilingPoint 184.13 °C
gptkbp:CASNumber 62-53-3
gptkbp:category toxic substances
aromatic compounds
primary amines
gptkbp:chemicalFormula C6H7N
gptkbp:density 1.0217 g/cm³
gptkbp:discoveredBy gptkb:Otto_Unverdorben
gptkbp:discoveredIn 1826
gptkbp:EC_number 200-539-3
gptkbp:flammability combustible
gptkbp:Gmelin_number 836
gptkbp:hasInChIKey InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2
PAYRUJLWNCNPSJ-UHFFFAOYSA-N
gptkbp:hasSMILES c1ccccc1N
https://www.w3.org/2000/01/rdf-schema#label Anilin
gptkbp:IUPACName aniline
gptkbp:KEGGID C01443
gptkbp:meltingPoint −6.3 °C
gptkbp:molecularWeight 93.13 g/mol
gptkbp:pKa 4.6
gptkbp:predecessor gptkb:paracetamol
acetanilide
aniline dyes
sulfa drugs
indigo dye
methylene diphenyl diisocyanate (MDI)
gptkbp:primaryUse pharmaceuticals
dye manufacture
precursor to polyurethane
gptkbp:PubChem_CID 6115
5882
CHBI:17296
gptkbp:refractiveIndex 1.5862 (20 °C)
gptkbp:riskFactor toxic
possible carcinogen
gptkbp:solubility 3.6 g/100 mL (20 °C)
gptkbp:structure benzene ring with amino group
gptkbp:UNII U16MFU4M7T
gptkbp:uses explosives
herbicides
antioxidants
agrochemicals
varnishes
photographic chemicals
rubber processing chemicals
various organic syntheses
gptkbp:vaporPressure 0.6 mmHg (20 °C)
gptkbp:bfsParent gptkb:Karl_Aloys_Schenzinger
gptkbp:bfsLayer 7