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Estragole

analytical standard

Sinônimo(s):

4-Allylanisole, p-Allylphenyl methyl ether, p-Methoxyallylbenzene, Chavicol methyl ether, Estragole, Isoanethole, Methyl chavicol

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About This Item

Fórmula linear:
H2C=CHCH2C6H4OCH3
Número CAS:
140-67-0
Peso molecular:
148.20
Beilstein:
1099454
Número CE:
205-427-8
Número MDL:
MFCD00008653
Código UNSPSC:
85151701
ID de substância PubChem:
329754812
NACRES:
NA.24

grau

analytical standard

Nível de qualidade

100

prazo de validade

limited shelf life, expiry date on the label

técnica(s)

HPLC: suitable
gas chromatography (GC): suitable

índice de refração

n20/D 1.521 (lit.)

p.e.

215-216 °C (lit.)

densidade

0.965 g/mL at 25 °C (lit.)

aplicação(ões)

cleaning products
cosmetics
flavors and fragrances
food and beverages
personal care

Formato

neat

cadeia de caracteres SMILES

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

chave InChI

ZFMSMUAANRJZFM-UHFFFAOYSA-N

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Descrição geral

Estragole is a plant extract, used in a variety of consumer products including flavorings, perfumes and homeopathic remedies. This compound exists as a natural constituent in a variety of plants and their essential oils, including, sweet basil, sweet fennel, tarragon and Croton zehntneri which are used in food products as flavoring agents.

Aplicação

Estragole may be used as an analytical reference standard for the quantification of the analyte in food products, Croton zehntneri aromatic plant, pharmaceutical products, herbal teas and herbal extracts using gas chromatography coupled with flame ionization detection (GC-FID) and gas chromatography coupled to mass spectrometry (GC-MS).
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.

Outras notas

This compound is commonly found in plants of the genus: pimpinella

Pictogramas

Health hazardExclamation mark
GHS08,GHS07

Palavra indicadora

Warning

Classificações de perigo

Acute Tox. 4 Oral - Aquatic Chronic 3 - Carc. 2 - Eye Irrit. 2 - Muta. 2 - Skin Irrit. 2 - Skin Sens. 1

Código de classe de armazenamento

10 - Combustible liquids

Classe de risco de água (WGK)

WGK 2

Ponto de fulgor (°F)

177.8 °F - closed cup

Ponto de fulgor (°C)

81 °C - closed cup

Equipamento de proteção individual

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Certificados de análise (COA)

Lot/Batch Number
BCCJ3685
BCCG6987
BCCC3789
BCBV9222
BCBV2082

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Determination of Estragole in Pharmaceutical Products, Herbal Teas and Herbal Extracts Using GC-FID
Ismaiel AO, et al.
Journal of Applied Pharmaceutical Science, 6(12), 144-150 (2016)
Alicia Paini et al.
Toxicology and applied pharmacology, 245(1), 57-66 (2010-02-11)
Estragole has been shown to be hepatocarcinogenic in rodent species at high-dose levels. Translation of these results into the likelihood of formation of DNA adducts, mutation, and ultimately cancer upon more realistic low-dose exposures remains a challenge. Recently we have
Yuta Suzuki et al.
Archives of toxicology, 86(10), 1593-1601 (2012-05-12)
Estragole (ES) is a natural organic compound used frequently as a flavoring food additive. Although it has been reported to be tumorigenic and induce DNA adducts in the mouse liver, there have been no reports regarding ES hepatocarcinogenicity in rats.
Antonio Raffo et al.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 49(2), 370-375 (2010-11-26)
Quantification of estragole content in commercial fennel herbal teas was carried out in order to allow for a more accurate estimate of the dietary exposure to estragole. A simple and rapid analytical method, based on Stir Bar Sorptive Extraction and
W Alhusainy et al.
Toxicology and applied pharmacology, 245(2), 179-190 (2010-03-17)
Estragole is a natural constituent of several herbs and spices including sweet basil. In rodent bioassays, estragole induces hepatomas, an effect ascribed to estragole bioactivation to 1'-sulfooxyestragole resulting in DNA adduct formation. The present paper identifies nevadensin as a basil
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