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Merck
CN

W288101

亚苄基丙酮

≥98%, FG

别名:

亚苄基丙酮, 甲基苯乙烯基酮, 苄叉丙酮

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关于此项目

线性分子式:
C6H5CH=CHCOCH3
化学文摘社编号:
分子量:
146.19
FEMA Number:
2881
Council of Europe no.:
158
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
7.024
EC Number:
204-555-1
NACRES:
NA.21
MDL number:
Beilstein/REAXYS Number:
742047
Organoleptic:
anise; cinnamon; jam; balsamic; spicy; floral; sweet
Grade:
FG
Halal
Kosher
Biological source:
synthetic
Agency:
meets purity specifications of JECFA
Food allergen:
no known allergens
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产品名称

亚苄基丙酮, ≥98%, FG

SMILES string

[H]\C(=C(\[H])c1ccccc1)C(C)=O

InChI

1S/C10H10O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-8H,1H3/b8-7+

InChI key

BWHOZHOGCMHOBV-BQYQJAHWSA-N

biological source

synthetic

grade

FG
Halal
Kosher

agency

meets purity specifications of JECFA

reg. compliance

EU Regulation 1334/2008 & 872/2012
FDA 21 CFR 172.515

vapor pressure

0.01 mmHg ( 25 °C)

assay

≥98%

bp

260-262 °C (lit.)

mp

39-42 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

organoleptic

anise; cinnamon; jam; balsamic; spicy; floral; sweet

Quality Level

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Biochem/physiol Actions

5-10ppm 时的味道

Other Notes

天然存在:大豆和弗吉尼亚烟草。

General description

Benzylideneacetone is used in the fragrance industry for its sweet pea-like odor. It is one of the major constituents of Monanthotaxis capea essential oil. Studies suggest that apart from skatole and androstenone, benzylideneacetone may also be one of the volatile compounds, which contributes to the development of boar taint in fat samples.

pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Skin Irrit. 2 - Skin Sens. 1

存储类别

11 - Combustible Solids

wgk

WGK 2

flash_point_f

253.4 °F - closed cup

flash_point_c

123 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves


历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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Phenylbutane Derivatives as Main Constituents of Monanthotaxis capea Essential Oil.
Lamaty G, et al.
J. Essent. Oil Res., 4(1), 33-39 (1992)
Role of 4-phenyl-3-buten-2-one in boar taint: identification of new compounds related to sensorial descriptors in pig fat.
Rius Sole MA & Garcia Regueiro JA.
Journal of Agricultural and Food Chemistry, 49(11), 5303-5309 (2001)
Ikuro Abe et al.
The Journal of biological chemistry, 278(27), 25218-25226 (2003-05-02)
Benzalacetone synthase (BAS) and chalcone synthase (CHS) are plant-specific type III polyketide synthases (PKSs) that share approximately 70% amino acid sequence identity. BAS catalyzes a one-step decarboxylative condensation of 4-coumaroyl-CoA with malonyl-CoA to produce a diketide benzalacetone, whereas CHS performs
Hiroyuki Morita et al.
Proceedings of the National Academy of Sciences of the United States of America, 107(2), 669-673 (2010-01-19)
Benzalacetone synthase (BAS), a plant-specific type III polyketide synthase (PKS), catalyzes a one-step decarboxylative condensation of malonyl-CoA and 4-coumaroyl-CoA to produce the diketide benzalacetone. We solved the crystal structures of both the wild-type and chalcone-producing I207L/L208F mutant of Rheum palmatum
Bowon Kwon et al.
Journal of economic entomology, 101(1), 36-41 (2008-03-12)
Benzylideneacetone (BZA) is a metabolite of gram-negative entomopathogenic bacterium Xenorhabdus nematophila, and it acts as an enzyme inhibitor against phospholipase A2 (PLA2). PLA2 catalyzes a committed biosynthetic step of eicosanoids, which mediate insect immune reactions to infection by microbial pathogens.

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