25539

Hexyl acetate

analytical standard

• Synonym(s): Capryl acetate
• Linear Formula: CH₃COO(CH₂)₅CH₃
• CAS Number: 142-92-7
• Molecular Weight: 144.21
• UNSPSC Code: 85151701
• NACRES: NA.24
• PubChem Substance ID: 329752793
• EC Number: 205-572-7
• Beilstein/REAXYS Number: 1747138
• MDL number: MFCD00009524

Properties

• grade: analytical standard
• Quality Segment: 100
• 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

Description

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.

Safety Information

• pictograms: GHS02,GHS09
• signalword: Warning
• hcodes: H226,H411
• pcodes: P210 - P233 - P240 - P241 - P242 - P273
• 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