Welcome to LookChem.com Sign In|Join Free
  • or
ETHYL CROTONATE, also known as Crotonic Acid Ethyl Ester, is a clear colorless liquid with a pungent odor. It has a powerful, sour, caramellic-fruity odor and is less dense than water, being insoluble in water. The flash point of ETHYL CROTONATE is 36°F, and its vapors are heavier than air. It is found in various natural sources such as Fragaria vesca, guava fruit, guava peel, pineapple, white wine, yellow passion fruit, fresh mango, naranjilla fruit, mussel, loganberry, apple, papaya, concord grape, strawberry, rum, cocoa, plum, kiwifruit, and others.

10544-63-5

Post Buying Request

10544-63-5 Suppliers

Recommended suppliers

  • Product
  • FOB Price
  • Min.Order
  • Supply Ability
  • Supplier
  • Contact Supplier

10544-63-5 Usage

Uses

Used in Pharmaceutical Industry:
ETHYL CROTONATE is used as an intermediate for the preparation of various pharmaceutical compounds. It plays a crucial role in the synthesis of (+)-trans-Trikentrin A, which has potential applications in the development of new drugs.
Used in Flavor and Fragrance Industry:
ETHYL CROTONATE is used as a flavoring agent for its rum, cognac, and pungent caramellic-fruity nuances. It is particularly effective at a taste threshold value of 10 ppm, adding depth and complexity to the flavor profiles of various food and beverage products.
Used in Research and Development:
Due to its occurrence in numerous natural sources, ETHYL CROTONATE is also utilized in research and development for studying the chemical composition and properties of these sources. This helps in understanding the role of ETHYL CROTONATE in the overall flavor, aroma, and potential therapeutic properties of these natural products.

Preparation

By esterification of crotonic acid with ethyl alcohol in the presence of concentrated H2SO4.

Synthesis Reference(s)

Journal of the American Chemical Society, 112, p. 2716, 1990 DOI: 10.1021/ja00163a038Synthetic Communications, 14, p. 701, 1984 DOI: 10.1080/00397918408059583

Air & Water Reactions

Highly flammable. Insoluble in water.

Reactivity Profile

ETHYL CROTONATE is an ester. Esters react with acids to liberate heat along with alcohols and acids. Strong oxidizing acids may cause a vigorous reaction that is sufficiently exothermic to ignite the reaction products. Heat is also generated by the interaction of esters with caustic solutions. Flammable hydrogen is generated by mixing esters with alkali metals and hydrides.

Health Hazard

May cause toxic effects if inhaled or absorbed through skin. Inhalation or contact with material may irritate or burn skin and eyes. Fire will produce irritating, corrosive and/or toxic gases. Vapors may cause dizziness or suffocation. Runoff from fire control or dilution water may cause pollution.

Fire Hazard

HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames. Vapors may form explosive mixtures with air. Vapors may travel to source of ignition and flash back. Most vapors are heavier than air. They will spread along ground and collect in low or confined areas (sewers, basements, tanks). Vapor explosion hazard indoors, outdoors or in sewers. Runoff to sewer may create fire or explosion hazard. Containers may explode when heated. Many liquids are lighter than water.

Safety Profile

Slightly toxic by ingestion. Corrosive. An eye irritant and lachrymator. A flammable liquid. When heated to decomposition it emits acrid smoke and irritating fumes.

Check Digit Verification of cas no

The CAS Registry Mumber 10544-63-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,0,5,4 and 4 respectively; the second part has 2 digits, 6 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 10544-63:
(7*1)+(6*0)+(5*5)+(4*4)+(3*4)+(2*6)+(1*3)=75
75 % 10 = 5
So 10544-63-5 is a valid CAS Registry Number.
InChI:InChI=1/C6H10O2/c1-3-5-6(7)8-4-2/h3,5H,4H2,1-2H3/b5-3+

10544-63-5SDS

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 Ethyl crotonate

1.2 Other means of identification

Product number -
Other names Ethyl 2-butenoate

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only. Food additives -> Flavoring Agents
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:10544-63-5 SDS

10544-63-5Relevant academic research and scientific papers

Reactions of β-Lactones with Potassium Alkoxides and Their Complexes with 18-Crown-6 in Aprotic Solvents

Kurcok, Piotr,Jedlinski, Zbigniew,Kowalczuk, Marek

, p. 4219 - 4220 (1993)

The mechanism of the reaction of β-lactones (2-oxetanones) with potassium alkoxides in aprotic solvents was investigated.Despite previous suggestions, the attack of alkoxide ion occurs on the carbonyl carbon atom of β-lactones, cleaving the acyl-oxygen bond to yield the corresponding potassium alcoholate of the respective β-hydroxycarboxylic acid ester.Next, the unsaturated ester is formed due to potassium hydroxide elimination.The nature of the alkoxide used and complexation of alkali metal cation by crown ether have no significant effect on the reaction course in aprotic solvents.

TMSCl-mediated catalytic carbocupration of alkynoates: An unprecedented and remarkable effect of catalyst loading on highly selective stereochemical induction via a TMS-allenoate intermediate

Jennings, Michael P.,Sawant, Kailas B.

, p. 3201 - 3204 (2004)

The TMSCl-mediated catalytic carbocupration of alkynoates has been investigated. It has been shown that catalyst loadings as low as 30 mol% readily allow for high yields and diastereoselectivities for a series of Grignard reagents. In addition, an unprecedented and remarkable effect of catalyst loading on stereochemical induction has been observed. ( Wiley-VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2004).

Olefination via Cu-Mediated Dehydroacylation of Unstrained Ketones

Dong, Guangbin,Xu, Yan,Zhou, Xukai

supporting information, p. 20042 - 20048 (2021/12/03)

The dehydroacylation of ketones to olefins is realized under mild conditions, which exhibits a unique reaction pathway involving aromatization-driven C-C cleavage to remove the acyl moiety, followed by Cu-mediated oxidative elimination to form an alkene between the α and β carbons. The newly adopted N′-methylpicolinohydrazonamide (MPHA) reagent is key to enable efficient cleavage of ketone C-C bonds at room temperature. Diverse alkyl- and aryl-substituted olefins, dienes, and special alkenes are generated with broad functional group tolerance. Strategic applications of this method are also demonstrated.

Merging Halogen-Atom Transfer (XAT) and Cobalt Catalysis to Override E2-Selectivity in the Elimination of Alkyl Halides: A Mild Route towardcontra-Thermodynamic Olefins

Zhao, Huaibo,McMillan, Alastair J.,Constantin, Timothée,Mykura, Rory C.,Juliá, Fabio,Leonori, Daniele

supporting information, p. 14806 - 14813 (2021/09/18)

We report here a mechanistically distinct tactic to carry E2-type eliminations on alkyl halides. This strategy exploits the interplay of α-aminoalkyl radical-mediated halogen-atom transfer (XAT) with desaturative cobalt catalysis. The methodology is high-yielding, tolerates many functionalities, and was used to access industrially relevant materials. In contrast to thermal E2 eliminations where unsymmetrical substrates give regioisomeric mixtures, this approach enables, by fine-tuning of the electronic and steric properties of the cobalt catalyst, to obtain high olefin positional selectivity. This unprecedented mechanistic feature has allowed access tocontra-thermodynamic olefins, elusive by E2 eliminations.

Stereospecific Hydrogenolysis of Lactones: Application to the Total Syntheses of (R)-ar-Himachalene and (R)-Curcumene

Spielmann, Kim,De Figueiredo, Renata Marcia,Campagne, Jean-Marc

, p. 4737 - 4743 (2017/05/12)

A straightforward strategy for the syntheses of curcumene and ar-himachalene is reported. Synthetic highlights include a catalytic and asymmetric vinylogous Mukaiyama reaction and a stereospecific hydrogenolysis of a tertiary benzylic center using Pd/C or Ni/Raney catalysts. Notably, using Ni/Raney, the stereoselectivity outcome (inversion vs retention) of the hydrogenolysis depends on the tertiary benzylic alcohol substitution.

Method for synthesizing muscone by utilizing beta-monomethyl methylglutarate

-

Paragraph 0021; 0022, (2017/12/05)

The invention discloses a method for synthesizing muscone by utilizing beta-monomethyl methylglutarate. According to the method, beta-monomethyl methylglutarate and alpha,omega-dodecanedioic acid monomethyl ester respectively prepared through a heteropoly acid catalytic transesterification method are used as raw materials, and Kolbe electrolysis, acyloin condensation and reduction reaction are performed to prepare the muscone. The method of the present invention has advantages of high raw material utilization rate, mold condition, easy control and environmental protection, and is suitable for industrial production .

A mild method for the replacement of a hydroxyl group by halogen. 1. Scope and chemoselectivity

Munyemana, Fran?ois,George, Isabelle,Devos, Alain,Colens, Alain,Badarau, Eduard,Frisque-Hesbain, Anne-Marie,Loudet, Aurore,Differding, Edmond,Damien, Jean-Marie,Rémion, Jeanine,Van Uytbergen, Jacqueline,Ghosez, Léon

, p. 420 - 430 (2015/12/31)

α-Chloro-, bromo- and iodoenamines, which are readily prepared from the corresponding isobutyramides have been found to be excellent reagents for the transformation of a wide variety of alcohols or carboxylic acids into the corresponding halides. Yields are high and conditions are very mild thus allowing for the presence of sensitive functional groups. The reagents can be easily tuned allowing therefore the selective monohalogenation of polyhydroxylated molecules. The scope and chemoselectivity of the reactions have been studied and reaction mechanisms have been proposed.

Borane-Catalyzed Reductive α-Silylation of Conjugated Esters and Amides Leaving Carbonyl Groups Intact

Kim, Youngchan,Chang, Sukbok

supporting information, p. 218 - 222 (2016/01/25)

Described herein is the development of the B(C6F5)3-catalyzed hydrosilylation of α,β-unsaturated esters and amides to afford synthetically valuable α-silyl carbonyl products. The α-silylation occurs chemoselectively, thus leaving the labile carbonyl groups intact. The reaction features a broad scope of both acyclic and cyclic substrates, and the synthetic utility of the obtained α-silyl carbonyl products is also demonstrated. Mechanistic studies revealed two operative steps: fast 1,4-hydrosilylation of conjugated carbonyls and then slow silyl group migration of a silyl ether intermediate.

Acrylates via Metathesis of Crotonates

Schweitzer, Dirk,Snell, Kristi D.

supporting information, p. 715 - 720 (2015/07/27)

Crotonic acid has the potential to be produced from renewable resources at low cost but currently has a limited market. We are investigating catalytic routes to exploit the functionalities of crotonic acid to produce a range of established industrial chemicals. Here we report our work on converting crotonates to acrylates, where a cost-competitive bio-based alternative can provide a market advantage. Our optimized reaction conditions for the cross-metathesis between crotonates and ethylene resulted in an increase in catalyst turnover numbers by 2 orders of magnitude compared with literature values. Control experiments showed the cross-metathesis with ethylene to be an equilibrium reaction. The turnover-number-limiting factor was found to be the stability of the metathesis catalyst.

PROCESS FOR PRODUCING (R)-3-HYDROXYBUTYL (R)-3-HYDROXYBUTYRATE

-

Page/Page column 6; 7, (2014/09/29)

A process for the production of (R)-3-hydroxybutyl (R)-3-hydroxybutyrate comprising: i) contacting poly-(R)-3-hydroxybutyrate with an alcohol to transesterify the poly-(R)-3-hydroxybutyrate under transesterification conditions to produce an ester of (R)-3-hydroxybutyrate and the alcohol; ii) separating the product of step i) into a first and second portion and reducing the first portion of the (R) 3-hydroxybutyrate ester to form (R)-1,3-butanediol; and iii) contacting under transesterification conditions the (R)-1,3-butanediol from step ii) with the second portion of the transesterified ester to produce (R)-3-hydroxybutyl-(R)-hydroxybutanoate.

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1 Customer Service

What can I do for you?
Get Best Price

Get Best Price for 10544-63-5