|
gptkbp:instanceOf
|
gptkb:fat
gptkb:carboxylic_acid
|
|
gptkbp:appearance
|
colorless to pale yellow liquid
|
|
gptkbp:aroma
|
unpleasant, rancid-like odor
|
|
gptkbp:boilingPoint
|
239.7 °C
|
|
gptkbp:CASNumber
|
124-07-2
|
|
gptkbp:chemicalFormula
|
C8H16O2
|
|
gptkbp:commonName
|
gptkb:caprylic_acid
|
|
gptkbp:density
|
0.910 g/cm³
|
|
gptkbp:foundIn
|
coconut oil
palm kernel oil
milk of various mammals
|
|
gptkbp:hasInChIKey
|
InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)
|
|
gptkbp:hasSMILES
|
CCCCCCCC(=O)O
|
|
gptkbp:IUPACName
|
gptkb:octanoic_acid
|
|
gptkbp:KEGGID
|
C06424
|
|
gptkbp:meltingPoint
|
16.3 °C
|
|
gptkbp:molecularWeight
|
144.21 g/mol
|
|
gptkbp:PubChem_CID
|
379
28837
CHEMBL15812
|
|
gptkbp:riskFactor
|
causes serious eye irritation
causes skin irritation
|
|
gptkbp:solubility
|
slightly soluble
|
|
gptkbp:UNII
|
6T8X9NS3NP
|
|
gptkbp:uses
|
gptkb:antibiotic
manufacture of perfumes
production of dyes
synthesis of esters
|
|
gptkbp:bfsParent
|
gptkb:2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanoic_acid
|
|
gptkbp:bfsLayer
|
7
|
|
https://www.w3.org/2000/01/rdf-schema#label
|
octanoic acid
|