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Merck
CN

W241105

4-烯丙基苯甲醚

≥98%, FCC

别名:

对烯丙基苯甲醚, 爱草脑, 甲基胡椒酚, 胡椒酚甲醚, 草蒿脑

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线性分子式:
H2C=CHCH2C6H4OCH3
化学文摘社编号:
140-67-0
分子量:
148.20
NACRES:
NA.21
PubChem Substance ID:
24901051
UNSPSC Code:
12164502
Council of Europe no.:
184
EC Number:
205-427-8
MDL number:
MFCD00008653
Beilstein/REAXYS Number:
1099454
Organoleptic:
anise; green; spicy; herbaceous; minty; sweet
Grade:
Fragrance grade, Halal, Kosher
Biological source:
synthetic
Agency:
follows IFRA guidelines
Food allergen:
no known allergens

主要文件

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InChI key

ZFMSMUAANRJZFM-UHFFFAOYSA-N

InChI

1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3

SMILES string

COc1ccc(CC=C)cc1

biological source

synthetic

grade

Fragrance grade, Halal, Kosher

agency

follows IFRA guidelines

reg. compliance

EU Regulation 1223/2009, FCC, FDA 21 CFR 117, FDA 21 CFR 172.515

assay

≥98%

composition

Contains IFRA restricted 4-Allylanisole

refractive index

n20/D 1.521 (lit.)

bp

215-216 °C (lit.)

density

0.965 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

fragrance allergen

no known allergens

organoleptic

anise; green; spicy; herbaceous; minty; sweet

Quality Level

300, 400

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Disclaimer

For R&D or non-EU Food use. Not for retail sale.

pictograms

Health hazardExclamation mark
GHS08,GHS07

signalword

Warning

Hazard Classifications

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

存储类别

10 - Combustible liquids

wgk

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

历史批次信息供参考:

分析证书(COA)

Lot/Batch Number
SHBT0216
SHBS5643
SHBN9869
SHBN9236
SHBN5858

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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
M De Vincenzi et al.
Fitoterapia, 71(6), 725-729 (2000-11-15)
Estragole (ES) is a natural constituent of a number of plants (e.g. tarragon, sweet basil and sweet fennel) and their essential oils have been widely used in foodstuffs as flavouring agents. Several studies with oral, i.p. or s.c. administration to
David Fowler et al.
Philosophical transactions of the Royal Society of London. Series B, Biological sciences, 366(1582), 3196-3209 (2011-10-19)
This paper reports measurements of land-atmosphere fluxes of sensible and latent heat, momentum, CO(2), volatile organic compounds (VOCs), NO, NO(2), N(2)O and O(3) over a 30 m high rainforest canopy and a 12 m high oil palm plantation in the
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
Alicia Paini et al.
Mutagenesis, 27(6), 653-663 (2012-07-31)
Estragole is a naturally occurring food-borne genotoxic compound found in a variety of food sources, including spices and herbs. This results in human exposure to estragole via the regular diet. The objective of this study was to quantify the dose-dependent
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