|
gptkbp:instanceOf
|
gptkb:chemical_compound
alkylamine
|
|
gptkbp:appearance
|
colorless liquid
|
|
gptkbp:aroma
|
ammonia-like
|
|
gptkbp:boilingPoint
|
77.9 °C
|
|
gptkbp:CASNumber
|
109-73-9
|
|
gptkbp:category
|
primary amine
n-alkylamine
|
|
gptkbp:chemicalFormula
|
C4H11N
|
|
gptkbp:density
|
0.74 g/cm³
|
|
gptkbp:EC_number
|
203-695-6
|
|
gptkbp:GHS_signal_word
|
Danger
|
|
gptkbp:hasInChIKey
|
InChI=1S/C4H11N/c1-2-3-4-5/h2-5H2,1H3
|
|
gptkbp:hasSMILES
|
CCCCN
|
|
https://www.w3.org/2000/01/rdf-schema#label
|
Butylamine
|
|
gptkbp:IUPACName
|
butan-1-amine
|
|
gptkbp:KEGGID
|
C02336
|
|
gptkbp:meltingPoint
|
-49.5 °C
|
|
gptkbp:molecularWeight
|
73.14 g/mol
|
|
gptkbp:pKa
|
10.77
|
|
gptkbp:PubChem_CID
|
gptkb:CHEMBL14237
8004
7712
28836
|
|
gptkbp:relatedTo
|
isobutylamine
sec-butylamine
tert-butylamine
|
|
gptkbp:riskFactor
|
flammable
corrosive
|
|
gptkbp:solubility
|
miscible
|
|
gptkbp:structure
|
linear chain of four carbon atoms with an amino group at one end
|
|
gptkbp:UNNumber
|
1125
|
|
gptkbp:uses
|
pesticides
pharmaceuticals
chemical intermediate
rubber accelerators
|
|
gptkbp:bfsParent
|
gptkb:UN_0081
|
|
gptkbp:bfsLayer
|
6
|