|
gptkbp:instanceOf
|
gptkb:phenol
|
|
gptkbp:antimicrobialActivity
|
yes
|
|
gptkbp:antioxidantActivity
|
yes
|
|
gptkbp:appearance
|
colorless to pale yellow oily liquid
|
|
gptkbp:aroma
|
clove-like
|
|
gptkbp:boilingPoint
|
254 °C
|
|
gptkbp:CASNumber
|
97-53-0
|
|
gptkbp:chemicalFormula
|
C10H12O2
|
|
gptkbp:density
|
1.06 g/cm³
|
|
gptkbp:EC_number
|
202-589-1
|
|
gptkbp:firstIsolatedFrom
|
gptkb:Jean-Baptiste_Dumas
1833
|
|
gptkbp:foundIn
|
essential oils
|
|
gptkbp:hasInChIKey
|
YDJXJWLXYCCOCG-UHFFFAOYSA-N
|
|
gptkbp:hasSMILES
|
C=CC1=CC(=C(C=C1)O)OC
|
|
gptkbp:IUPACName
|
4-allyl-2-methoxyphenol
|
|
gptkbp:KEGGID
|
C01788
|
|
gptkbp:LD50
|
1930 mg/kg (rat, oral)
|
|
gptkbp:meltingPoint
|
−7.5 °C
|
|
gptkbp:MeSH_ID
|
D004576
|
|
gptkbp:molecularWeight
|
164.20 g/mol
|
|
gptkbp:PubChem_CID
|
CHEMBL1425
3314
CHEBI:4887
|
|
gptkbp:relatedTo
|
gptkb:methyl_eugenol
vanillin
isoeugenol
|
|
gptkbp:riskFactor
|
H302
H315
H319
H411
H317
|
|
gptkbp:solubility
|
slightly soluble
|
|
gptkbp:solubilityInEthanol
|
soluble
|
|
gptkbp:source
|
gptkb:cinnamon
basil
nutmeg
bay leaf
clove oil
|
|
gptkbp:toxicity
|
moderate
|
|
gptkbp:UNII
|
3T8H1794Q1
|
|
gptkbp:usedIn
|
gptkb:root_canal_therapy
temporary dental fillings
|
|
gptkbp:uses
|
gptkb:analgesic
gptkb:entomologist
gptkb:perfume
dentistry
flavoring agent
insect attractant
local antiseptic
synthesis of vanillin
|
|
gptkbp:bfsParent
|
gptkb:Clove
gptkb:Holy_basil
gptkb:Mace_(spice)
|
|
gptkbp:bfsLayer
|
6
|
|
https://www.w3.org/2000/01/rdf-schema#label
|
Eugenol
|