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Trimethylphenylbutenone, also known as (3E)-4-(2,3,6-trimethylphenyl)-3-buten-2-one or (E)-4-(2,3,6-trimethylphenyl)-3-buten-2-one, is a chemical compound with a molecular formula of C13H16O. It belongs to the family of phenylbutenones and is characterized by a substituted phenyl ring attached to a butenone group. This aromatic compound is known for its pleasant scent and potential biological activities, such as antioxidant and anti-inflammatory properties, making it valuable in various industries and applications.

57461-21-9

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57461-21-9 Usage

Uses

Used in Pharmaceutical Industry:
Trimethylphenylbutenone is used as an intermediate in the synthesis of various pharmaceuticals due to its unique chemical structure and properties. Its potential biological activities, such as antioxidant and anti-inflammatory properties, contribute to the development of new drugs with therapeutic benefits.
Used in Fragrance Industry:
Trimethylphenylbutenone is used as a fragrance ingredient in perfumes and colognes for its pleasant and aromatic scent. Its ability to enhance the overall fragrance profile makes it a valuable addition to the fragrance industry.
Used in Flavoring Industry:
Trimethylphenylbutenone is used as a flavoring agent in the food industry, adding a unique and desirable taste to various food products. Its aromatic properties contribute to the overall flavor profile, enhancing the consumer's sensory experience.
Used in Antioxidant Applications:
Trimethylphenylbutenone's antioxidant properties make it a potential candidate for use in various applications where protection against oxidative stress is required. It can be used in the development of products that help prevent oxidative damage and promote overall health.
Used in Anti-Inflammatory Applications:
Due to its anti-inflammatory properties, trimethylphenylbutenone can be utilized in the development of products that target inflammation and provide relief from associated symptoms. This can be particularly beneficial in industries such as cosmetics and personal care, where inflammation can cause skin irritation and discomfort.

Check Digit Verification of cas no

The CAS Registry Mumber 57461-21-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,7,4,6 and 1 respectively; the second part has 2 digits, 2 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 57461-21:
(7*5)+(6*7)+(5*4)+(4*6)+(3*1)+(2*2)+(1*1)=129
129 % 10 = 9
So 57461-21-9 is a valid CAS Registry Number.

57461-21-9SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name (3E)-4-(2,3,6-trimethylphenyl)but-3-en-2-one

1.2 Other means of identification

Product number -
Other names 4t-(2,3,6-trimethyl-phenyl)-but-3-en-2-one

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:57461-21-9 SDS

57461-21-9Relevant academic research and scientific papers

Base-induced decarboxylation of polyunsaturated α-cyano acids derived from malonic acid: Synthesis of sesquiterpene nitriles and aldehydes with β-, φ-, and ψ-end groups

Dufossé, Laurent,Cartier, Dominique,Valla, Benoist,Fouillaud, Mireille,Labia, Roger,Valla, Alain

, p. 259 - 265 (2013/03/28)

Catalytic base-induced decarboxylation of polyunsaturated α-cyano-β-methyl acids derived from malonic acid led to the corresponding nitriles 3 (Schemes 2 and 3), 6 (Scheme 5), and 9 (Scheme 6). This decarboxylation occurred with previous deconjugation of

A new biomimetic-like aromatization of the cyclic end groups of terpenoids with stereospecific migration of one of the methyl groups: A convenient route to isorenieratene (φ,φ-carotene)

Valla, Alain,Andriamialisoa, Zo,Valla, Benoist,Labia, Roger,Le Guillou, Regis,Dufosse, Laurent,Cartier, Dominique

, p. 711 - 715 (2007/10/03)

The synthesis of isorenieratene, a natural carotenoid isolated from the marine sponge Reniera japonica and from some anoxygenic phototrophic bacteria or nonphotosynthetic actinomycetes, was performed from α-, β- and retro-ionones. In this series of cycloh

Selectivity in palladium catalyzed arylation: Synthetic application leading to aromatized ionone natural products

Hagiwara, Hisahiro,Eda, Yasushi,Morohashi, Kimie,Suzuki, Toshio,Ando, Masayoshi,Ito, Nobuhiko

, p. 4055 - 4058 (2007/10/03)

The selectivity in aromatic substitution vs conjugate addition during palladium catalyzed reactions has been controlled simply by changing the base. These reaction conditions have been applied to the syntheses of aromatized β-ionone natural products 1 and its dihydroderivatives 7.

A new synthesis of 4-(2,3,6-trimethylphenyl)butan-2-ol, a C13-norisoprenoid artifact from Vitis vinifera linn. and its conversion to several terpenic natural products of plant and marine origin

Sudalai, A.,Rao, Krishna G. S.

, p. 110 - 112 (2007/10/02)

The four-step synthesis of 4-(2,3,6-trimethylphenyl)butan-2-ol (1), starts from 5,8-dimethyl-3,4-dihydro-2-naphthaldehyde (2).The trimethyldihydronaphthalene (10) obtained from the reduction of 2 is ozonised to the keto aldehyde (11), which is reduced to

3-OXO-α-IONOL, VOMIFOLIOL AND ROSEOSIDE IN VITIS VINIFERA FRUIT

Strauss, Christopher R.,Wilson, Bevan,Williams, Patrick J.

, p. 1995 - 1998 (2007/10/02)

Key Word Index - Vitis vinifera; Vitaceae; grapes; 3-oxo-α-ionol; vomifoliol; dehydrovomifoliol; roseoside; hydrolytic studies. 3-Oxo-α-ionol, vomifoliol and dehydrovomifoliol were identified for the first time in fruit from Vitis vinifera.The last named compound was mainly present free in the juice while the others existed predominantly as conjugates.In the case of vomifoliol, the conjugation was with glucose, i.e. as roseoside.Hydrolytic studies on 3-oxo-α-ionol and vomifoliol gave a range of compounds which have been recognized as fruit and plant products.

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