05818

4-Allylanisole

analytical standard

• Synonym(s): p-Allylphenyl methyl ether, p-Methoxyallylbenzene, Chavicol methyl ether, Estragole, Isoanethole, Methyl chavicol
• Linear Formula: H₂C=CHCH₂C₆H₄OCH₃
• CAS Number: 140-67-0
• Molecular Weight: 148.20
• Beilstein/REAXYS Number: 1099454
• EC Number: 205-427-8
• MDL number: MFCD00008653
• UNSPSC Code: 85151701
• PubChem Substance ID: 329748173
• NACRES: NA.24

Properties

• grade: analytical standard
• Quality Level: 100
• assay: ≥98.5% (GC)
• shelf life: limited shelf life, expiry date on the label
• technique(s): HPLC: suitable; gas chromatography (GC): suitable
• refractive index: n20/D 1.521 (lit.); n20/D 1.521
• bp: 215-216 °C (lit.)
• density: 0.965 g/mL at 25 °C (lit.)
• application(s): food and beverages
• format: neat
• SMILES string: COc1ccc(CC=C)cc1
• InChI: 1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3
• InChI key: ZFMSMUAANRJZFM-UHFFFAOYSA-N

Description

General description

4-Allylanisole is one of the oxygenated aromatic biogenic volatile organic compounds (BVOCs) which is usually synthesized by plants.

Application

4-Allylanisole has been used as a reference standard for the analysis of 4-allylanisole in essential oils by high performance liquid chromatography (HPLC) equipped with fluorometric detector and in emissions from live vegetation by solid-phase microextraction (SPME) combined with proton transfer reaction mass spectrometry (PTR-MS). It may be used as a reference standard for the determination of 4-allylanisole in food products by simultaneous distillation-extraction (SDE) followed by analyses using capillary gas chromatography (GC)-flame ionization detector (FID) and GC-MS.

Safety Information

• pictograms: GHS08,GHS07
• signalword: Warning
• hcodes: H302,H315,H317,H319,H341,H351,H412
• pcodes: P273 - P280 - P301 + P312 - P302 + P352 - P305 + P351 + P338 - P308 + P313
• Hazard Classifications: Acute Tox. 4 Oral - Aquatic Chronic 3 - Carc. 2 - Eye Irrit. 2 - Muta. 2 - Skin Irrit. 2 - Skin Sens. 1
• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 2
• flash_point_f: 177.8 °F - closed cup
• flash_point_c: 81 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter