|
gptkbp:instanceOf
|
gptkb:chemical_compound
|
|
gptkbp:appearance
|
yellow oily liquid
|
|
gptkbp:aroma
|
cinnamon-like
|
|
gptkbp:autoignitionTemperature
|
435 °C
|
|
gptkbp:biosynthesized_from
|
from phenylalanine
|
|
gptkbp:boilingPoint
|
248 °C
|
|
gptkbp:CASNumber
|
104-55-2
|
|
gptkbp:chemicalFormula
|
C9H8O
|
|
gptkbp:color
|
pale yellow
|
|
gptkbp:component
|
cinnamon oil
|
|
gptkbp:density
|
1.05 g/cm³
|
|
gptkbp:firstIsolatedFrom
|
gptkb:Jean-Baptiste_Dumas
1834
|
|
gptkbp:flashPoint
|
71 °C
|
|
gptkbp:foundIn
|
essential oils
|
|
gptkbp:hasInChIKey
|
KJPRLNWUNMBNBZ-ONEGZZNKSA-N
|
|
gptkbp:hasSMILES
|
C1=CC=C(C=C1)C=CC=O
|
|
https://www.w3.org/2000/01/rdf-schema#label
|
Cinnamaldehyde
|
|
gptkbp:IUPACName
|
(E)-3-phenylprop-2-enal
|
|
gptkbp:KEGGID
|
gptkb:C10483
|
|
gptkbp:meltingPoint
|
−7.5 °C
|
|
gptkbp:molecularWeight
|
132.16 g/mol
|
|
gptkbp:occurredIn
|
cassia oil
cinnamon bark
|
|
gptkbp:precautions
|
avoid contact with skin and eyes
|
|
gptkbp:PubChem_CID
|
gptkb:CHEMBL31808
637511
CHEBI:28221
|
|
gptkbp:refractiveIndex
|
1.622
|
|
gptkbp:riskFactor
|
H315 (causes skin irritation)
H317 (may cause allergic skin reaction)
H319 (causes serious eye irritation)
|
|
gptkbp:solubility
|
slightly soluble
soluble in ethanol
soluble in diethyl ether
|
|
gptkbp:stable
|
stable under normal conditions
|
|
gptkbp:storage
|
store in cool, dry place
|
|
gptkbp:structureType
|
aromatic aldehyde
|
|
gptkbp:toxicity
|
moderate
|
|
gptkbp:UNII
|
L8C2LZ0H5T
|
|
gptkbp:uses
|
gptkb:entomologist
gptkb:food
gptkb:perfume
gptkb:antibiotic
pharmaceuticals
herbicide
flavoring agent
|
|
gptkbp:vaporPressure
|
0.03 mmHg (25 °C)
|
|
gptkbp:bfsParent
|
gptkb:Pure_Cinnamon
|
|
gptkbp:bfsLayer
|
6
|