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Benzyl 3-oxopentanoate, also known as 3-oxovaleryl benzoate, is an organic compound with the chemical formula C13H14O3. It is a colorless to pale yellow liquid with a fruity, floral, and green odor. This ester is formed by the reaction of benzyl alcohol and 3-oxopentanoic acid, and it is commonly used as a fragrance ingredient in various personal care products, such as perfumes, soaps, and lotions. Benzyl 3-oxopentanoate is also employed as a flavoring agent in food and beverages, imparting a sweet, fruity, and slightly floral taste. It is considered safe for use in these applications, but like many chemicals, it should be handled with care to avoid potential skin and eye irritation.

4949-45-5

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4949-45-5 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 4949-45-5 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,9,4 and 9 respectively; the second part has 2 digits, 4 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 4949-45:
(6*4)+(5*9)+(4*4)+(3*9)+(2*4)+(1*5)=125
125 % 10 = 5
So 4949-45-5 is a valid CAS Registry Number.

4949-45-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name benzyl 2-methylacetoacetate

1.2 Other means of identification

Product number -
Other names benzyl propionylacetate

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:4949-45-5 SDS

4949-45-5Relevant academic research and scientific papers

Oxone-promoted hydration of electron-deficient allenic esters and ketones into 1,3-dicarbonyl compounds

Yi, Yu-Ping,Zheng, Yan,Nie, Jing,Ma, Jun-An

, p. 4523 - 4526 (2015/06/30)

Abstract A novel and mild protocol for the hydration of electron-deficient allenic esters and ketones into various 1,3-dicarbonyl compounds is described. The hydration of allenes promoted by oxone in DMF afforded the corresponding products in moderate to good yields. This work features the employment of only a catalytic amount of inexpensive and nontoxic solid reagent oxone (2KHSO5·KHSO4·K2SO4), avoiding the utility of toxic metals or traditional Br?nsted acids, in a green version of viewpoint. A possible reaction mechanism for this transformation is also primarily proposed.

Synthesis of tetrahydropyridazines by a metal-carbene-directed enantioselective vinylogous N-H insertion/Lewis acid-catalyzed diastereoselective Mannich addition

Xu, Xinfang,Zavalij, Peter Y.,Doyle, Michael P.

supporting information, p. 9829 - 9833 (2012/11/07)

A versatile cascade of reactions, triggered by RhII-catalyzed diazo decomposition followed by a vinylogous N-H insertion/Lewis acid catalyzed Mannich addition, that produces highly substituted 1,2,3,6-tetrahydropyridazines in up to 97% ee with high yield and diastereocontrol has been developed. Copyright

Layered double hydroxides-supported diisopropylamide: Synthesis, characterization and application in organic reactions

Kantam, M. Lakshmi,Ravindra,Reddy, Ch. Venkat,Sreedhar,Choudary

, p. 569 - 578 (2007/10/03)

The layered double hydroxides-supported diisopropylamide (LDH-DA) catalyst is found to be an efficient and selective solid base for aldol, Knoevenagel, Henry, Michael, transesterification and epoxidation reactions under liquid phase conditions. LDH-DA is synthesized by the interaction of lithium diisopropylamide with LDH-NO3 (as-synthesized) and calcined LDH-NO3. The LDH-DA (Mg/Al, 3/1) and their precursors are well characterized by using various instrumental techniques such as FT-IR, TGA and DTA, powder XRD, solid state 27Al MAS NMR spectroscopy, SEM and XPS (ESCA).

Dihydropyridine derivative

-

Page column 38, (2008/06/13)

Dihydropyridine derivatives of the following formula, analogs thereof and pharmaceutically acceptable salts thereof have an activity of selectively inhibiting the action of N-type calcium channel. They are used as remedies for various diseases relating to the N-type calcium channel. STR1

A general synthesis of dioxolenone prodrug moieties

Sun, Chong-Qing,Cheng, Peter T.W.,Stevenson, Jay,Dejneka, Tamara,Brown, Baerbel,Wang, Tammy C.,Robl, Jeffrey A.,Poss, Michael A.

, p. 1161 - 1164 (2007/10/03)

A general method for the synthesis of dioxolenone prodrug moieties from appropriately substituted β-ketoesters is described. This novel and versatile sequence allows for the synthesis of alkyl- or aryl-substituted dioxolenone alcohols 8 or bromides 9. Coupling of the bromides 9 to prepare bis-dioxolenone phosphonate prodrug esters is also presented.

Antibiotic synthesis

-

, (2008/06/13)

A method of preparing intermediates for carbapenem antibiotics characterized by treating a N-deprotected acetoxy conpound of the formula: STR1 in the presence of a Lewis acid or a silylating agent to yeild an intermediate; and cyclizing the intermediate in the presence of rhodium (II) acetate to form a bicyclic ketoester.

BIOCHEMICAL PREPARATIONS OF BOTH THE ENANTIOMERS OF METHYL 3-HYDROXYPENTANOATE AND THEIR CONVERSION TO THE ENANTIOMERS OF 4-HEXANOLIDE, THE PHEROMONE OF TROGODERMA GLABRUM

Mori, Kenji,Mori, Hideto,Sugai, Takeshi

, p. 919 - 926 (2007/10/02)

Both the enantiomers of methyl 3-hydroxypentanoate were prepared by microbial asymmetric reduction of 3-oxopentanoic esters.Conversion of methyl 3-hydroxypentanoate to 4-hexanolide, the pheromone of Trogoderma glabrum, was achieved.

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