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Merck

05818

Supelco

4-烯丙基苯甲醚

analytical standard

别名:

烯丙基苯甲醚, 爱草脑, 甲基胡椒酚, 胡椒酚甲醚, 草蒿脑

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About This Item

线性分子式:
H2C=CHCH2C6H4OCH3
CAS号:
分子量:
148.20
Beilstein:
1099454
EC號碼:
MDL號碼:
分類程式碼代碼:
85151701
PubChem物質ID:
NACRES:
NA.24

等級

analytical standard

品質等級

化驗

≥98.5% (GC)

儲存期限

limited shelf life, expiry date on the label

技術

HPLC: suitable
gas chromatography (GC): suitable

折射率

n20/D 1.521 (lit.)
n20/D 1.521

bp

215-216 °C (lit.)

密度

0.965 g/mL at 25 °C (lit.)

應用

food and beverages

格式

neat

SMILES 字串

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 密鑰

ZFMSMUAANRJZFM-UHFFFAOYSA-N

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一般說明

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

應用

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.

象形圖

Health hazardExclamation mark

訊號詞

Warning

危險分類

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

儲存類別代碼

10 - Combustible liquids

水污染物質分類(WGK)

WGK 2

閃點(°F)

177.8 °F - closed cup

閃點(°C)

81 °C - closed cup

個人防護裝備

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


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分析证书(COA)

Lot/Batch Number

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Determination of fragrance allergens in essential oils and evaluation of their in vitro permeation from essential oil formulations through cultured skin.
Wang LH and Liu HJ
Journal of Analytical Chemistry, 67(1), 64-71 (2012)
Methyl chavicol: characterization of its biogenic emission rate, abundance, and oxidation products in the atmosphere.
Bouvier-Brown NC, et al.
Atmospheric Chemistry and Physics, 9(6), 2061-2074 (2009)
Determination of estragole, safrole and eugenol methyl ether in food products.
Siano F, et al.
Food Chemistry, 81(3), 469-475 (2003)
Wasma Alhusainy et al.
Toxicological sciences : an official journal of the Society of Toxicology, 129(1), 174-187 (2012-06-01)
The alkenylbenzene estragole is a constituent of several herbs and spices. It induces hepatomas in rodents at high doses following bioactivation by cytochrome P450s and sulfotransferases (SULTs) giving rise to the ultimate carcinogenic metabolite 1'-sulfooxyestragole which forms DNA adducts. Methanolic
Yuji Ishii et al.
Chemical research in toxicology, 24(4), 532-541 (2011-03-10)
Estragole (ES) is a natural constituent of several herbs and spices that acts as a carcinogen in the livers of rodents. Given that the proximal electrophilic form of ES with a reactive carbocation is generated by cytochrome P450 and a

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