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(E)-but-2-enal, also known as trans-2-butenal, is a chemical compound with the formula C4H6O. It is an aldehyde and exists as a colorless to pale yellow liquid with a pungent, fruity odor. (E)-but-2-enal is known for its sweet and fruity aroma, making it a popular choice as a flavoring agent in various industries.

15798-64-8

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15798-64-8 Usage

Uses

Used in Food and Beverage Industry:
(E)-but-2-enal is used as a flavoring agent for its sweet and fruity aroma, enhancing the taste and smell of food and beverages.
Used in Fragrance Industry:
(E)-but-2-enal is used as a precursor for the synthesis of fragrances, contributing to the creation of various scents in perfumes and other aromatic products.
Used in Pharmaceutical Industry:
(E)-but-2-enal is used as a precursor for the synthesis of pharmaceuticals, playing a role in the development of different medications.
Used in Plastics, Resins, and Rubber Industry:
(E)-but-2-enal is an important component in the production of plastics, resins, and rubber, contributing to the manufacturing process of these materials.
Safety Precautions:
Due to its highly reactive nature, (E)-but-2-enal can cause irritation to the eyes, skin, and respiratory system. It is essential to handle (E)-but-2-enal with caution to minimize potential health risks.

Check Digit Verification of cas no

The CAS Registry Mumber 15798-64-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,5,7,9 and 8 respectively; the second part has 2 digits, 6 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 15798-64:
(7*1)+(6*5)+(5*7)+(4*9)+(3*8)+(2*6)+(1*4)=148
148 % 10 = 8
So 15798-64-8 is a valid CAS Registry Number.
InChI:InChI=1S/C4H6O/c1-2-3-4-5/h2-4H,1H3/b3-2-

15798-64-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name (Z)-crotonaldehyde

1.2 Other means of identification

Product number -
Other names cis-crotonaldehyde

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:15798-64-8 SDS

15798-64-8Relevant academic research and scientific papers

Method for preparing Z-isomer by E-isomer of alpha, beta-nonsaturated carbonyl compound

-

Paragraph 0052; 0053, (2017/04/29)

The invention provides a method for preparing a Z-isomer by an E-isomer of an alpha, beta-nonsaturated carbonyl compound. The method uses nitrogen-containing chiral binaphthol phosphoramidite to prepare a catalyst, under mild reaction condition, the E-isomer of the alpha, beta-nonsaturated carbonyl compound is efficiently conversed to the Z-isomer. The method is especially suitable for preparing neral through isomerization of partial geranial in a citral split residual material, the citral with mol ratio of the obtained geranial to neral being 1:1 can be reused for splitting the neral, raw material utilization rate is increased, and the cost is reduced.

Isomerization and dissociation of 2,3-dihydrofuran (2,3-DHF) induced by infrared free electron laser

Matsubara,Osada,Nakajima,Imai,Nishimura,Oyama,Tsukiyama

, p. 53 - 59 (2016/04/26)

We investigated infrared multiphoton dissociation and isomerization reactions of 2,3-dihydrofuran (2,3-DHF), cyclopropanecaboxaldehyde (CPCA) and crotonaldehyde (CA) with free electron laser at Tokyo University of Science (FEL-TUS). From 2,3-DHF as a starting material, CPCA and CA were the main isomerization products. From the measured [CPCA]/[CA] ratio, the equivalent temperature for the vibrationally hot 2,3-DHF was estimated to be 1300-1500 K. From CPCA, both 2,3-DHF and CA were detected as isomerization products. No isomerization reaction from trans-CA to CPCA and 2,3-DHF was recognized and the dissociation to propylene was the dominant process. The experimentally identified reaction pathways are well explainable by quantum chemical calculations at the MP2/cc-pVDZ level.

Total synthesis and biological evaluation of (-)-exiguolide analogues: Importance of the macrocyclic backbone

Fuwa, Haruhiko,Mizunuma, Kana,Sasaki, Makoto,Suzuki, Takaya,Kubo, Hiroshi

supporting information, p. 3442 - 3450 (2013/07/05)

(-)-Exiguolide (1), isolated from the marine sponge Geodia exigua, has been shown to inhibit the growth of the A549 human lung adenocarcinoma and NCI-H460 human lung large cell carcinoma cells in vitro. In this study, we synthesized structural analogues o

An experimental (flash vacuum pyrolysis) and theoretical study of the tautomerism of pyrazolinones at high temperatures

Yranzo, Gloria I.,Moyano, Elizabeth L.,Rozas, Isabel,Dardonville, Christophe,Elguero, Jose

, p. 211 - 216 (2007/10/03)

Flash vacuum pyrolysis experiments were carried out between 500 and 800°C on 3(5)-phenyl- and 3(5)-methylpyrazolinones and on 3(5)-methoxy-5(3)-phenylpyrazole. The origin of the isolated products (mainly indanone, hydroxyalkynes and α,β-unsaturated aldehydes) can be explained as arising from the hydroxy tautomers of pyrazolinones. Temperature effects on the tautomeric equilibrium of 1-phenyl-3-methylpyrazolinone in solution show that the percentage of the CH tautomer increases with the temperature. MP2 ab initio calculations on the model compound, pyrazolinone itself, have been used to rationalize these findings. The problem of the aromaticity of the four tautomers of pyrazolinone has been examined through Schleyer's NICS (nuclear independent chemical shifts) calculations.

Synthesis of aromatic and αβ-unsaturated aldehydes by a friedel-crafts-like electrophilic destamylation using 1,1-dichloromethyl metyhyl ether

Niestroj, Michael,Neumann, Wilhelm P.

, p. 45 - 51 (2007/10/02)

A mild and effective method for the preparation of a variety of aromatic (7a-m), heteroaromatic (7n-r), and α,β-unsaturated aldehydes (8a-f) is described. The reaction of trialkylaryl- (2a-o), heteroaryl- (2p-t), and 1-alkenylstannanes (4a-f and 5a-f) with dichloromethyl methyl ether (1, DCME) in the presence of aluminium trichloride followed by hydrolysis provides the corresponding aldehydes. In the case of arylstannanes the ipso-isomers are generally formed; the p-alde-hydes occur as side products. The electrophilic substitution of 1-alkenylstannanes with 1 leads to α,β-unsaturated aldehydes In an ipso- and stereospecific manner. A comparison of the leaving abilities of the stannyl and silyl groups shows a lower or even zero reactivity of the silyl-substituted compounds 8a-e towards the electrophile 1. In the silylstannylalkene 6c only the stannyl group reacts whereas the stannyl function remains unaffected in the product, aldehyde 11.

Chemistry of Singlet Oxygen. 51. Zwitterionic Intermediates from 2,4-Hexadienes

O'Shea, Kevin E.,Foote, Christopher S.

, p. 7167 - 7170 (2007/10/02)

The three isomeric 2,4-hexadienes give nearly identical product distributions with singlet oxygen.Singlet oxygen causes rapid interconversion of the isomers, and methoxy hydroperoxides are formed from all three dienes in methanol (E,Z and Z,Z ca. 25 percent, E,E 10 percent).These observations are explained by intermediate zwitterions that revert to isomerized dienes in competition with collapse to products or capture by methanol.

STEREOSPECIFIC OXIDATION OF ALLYLIC ALCOHOLS

Al-Hassan, Mohammed I.

, p. 441 - 442 (2007/10/02)

Barium manganate has been found to be a convenient reagent for the oxidation of allylic alcohols to the isomerically pure products in excellent yields.

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