25539
Hexyl acetate
analytical standard
Synonym(s):
Capryl acetate
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About This Item
Linear Formula:
CH3COO(CH2)5CH3
CAS Number:
Molecular Weight:
144.21
UNSPSC Code:
85151701
NACRES:
NA.24
PubChem Substance ID:
EC Number:
205-572-7
Beilstein/REAXYS Number:
1747138
MDL number:
grade
analytical standard
Quality Segment
assay
≥99.7% (GC)
shelf life
limited shelf life, expiry date on the label
technique(s)
HPLC: suitable, gas chromatography (GC): suitable
refractive index
n20/D 1.409
bp
168-170 °C (lit.)
mp
−80 °C (lit.)
density
0.87 g/mL at 25 °C (lit.)
application(s)
cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care
format
neat
SMILES string
CCCCCCOC(C)=O
InChI
1S/C8H16O2/c1-3-4-5-6-7-10-8(2)9/h3-7H2,1-2H3
InChI key
AOGQPLXWSUTHQB-UHFFFAOYSA-N
General description
Hexyl acetate is a short-chain ester and an aromatic compound with a green note flavor, widely used in food industries.
Application
Hexyl acetate may be used as a volatile aroma reference standard for the analysis of the analyte in apples using solid-phase microextraction (SPME), time-compressed chromatography (TCC), and time-of-flight mass spectrometry (TOFMS) methods.
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
Other Notes
Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.
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signalword
Warning
hcodes
Hazard Classifications
Aquatic Chronic 2 - Flam. Liq. 3
Storage Class
3 - Flammable liquids
wgk
WGK 1
flash_point_f
132.8 °F - closed cup
flash_point_c
56 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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