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1(3H)-Isobenzofuranone, 3-(benzoyloxy)-, also known as benzoyloxy isobenzofuranone, is a chemical compound with a molecular formula C15H10O4. It is a derivative of isobenzofuranone, which is a cyclic lactone. 1(3H)-Isobenzofuranone, 3-(benzoyloxy)is characterized by its potential applications in various fields, including pharmaceuticals, organic chemistry, and the fragrance and flavoring industries.

56973-60-5

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56973-60-5 Usage

Uses

Used in Pharmaceutical Synthesis:
1(3H)-Isobenzofuranone, 3-(benzoyloxy)is used as a building block in the synthesis of pharmaceuticals for its ability to contribute to the development of new drugs and medications.
Used in Organic Chemistry Reactions:
In the field of organic chemistry, 1(3H)-Isobenzofuranone, 3-(benzoyloxy)serves as a valuable component in various chemical reactions, facilitating the creation of diverse chemical structures and compounds.
Used in Antimicrobial and Antifungals:
Due to its potential biological activities, 1(3H)-Isobenzofuranone, 3-(benzoyloxy)is used as an antimicrobial and antifungal agent, providing benefits in applications where these properties are desired.
Used in Fragrance and Flavoring Industry:
1(3H)-Isobenzofuranone, 3-(benzoyloxy)is used as a component in the preparation of fragrances and flavorings, capitalizing on its pleasant aroma to enhance the sensory experience of various products.
Safety Precautions:
It is important to handle 1(3H)-Isobenzofuranone, 3-(benzoyloxy)with care, as it can cause irritation to the skin, eyes, and respiratory tract. Proper safety measures should be taken during its use and handling to minimize potential health risks.

Check Digit Verification of cas no

The CAS Registry Mumber 56973-60-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,6,9,7 and 3 respectively; the second part has 2 digits, 6 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 56973-60:
(7*5)+(6*6)+(5*9)+(4*7)+(3*3)+(2*6)+(1*0)=165
165 % 10 = 5
So 56973-60-5 is a valid CAS Registry Number.

56973-60-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name (3-oxo-1H-2-benzofuran-1-yl) benzoate

1.2 Other means of identification

Product number -
Other names 3-benzoyloxy-3H-isobenzofuran-1-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:56973-60-5 SDS

56973-60-5Downstream Products

56973-60-5Relevant academic research and scientific papers

Facile palladium-catalyzed synthesis of 3-oxo-1,3-dihydro-1- isobenzofuranyl alkanoates from 2-bromobenzaldehyde and carboxylic acids

Cho, Chan Sik,Baek, Dong Yeol,Kim, Hye-Young,Shim, Sang Chul,Oh, Dae Hee

, p. 1139 - 1145 (2000)

2-Bromobenzaldehyde reacts with carboxylic acids in acetonitrile under carbon monoxide pressure in the presence of a catalytic amount of a palladium catalyst to give the corresponding 3-oxo-1,3-dihydro-1-isobenzofuranyl alkanoates in high yields.

Anhydrides of Arylfuran and Arylpyran Pseudoacids: Formation and Structures; C–O Bond Lengths Trends in Pseudo o-Formylbenzoic Acid Derivatives

O’Loughlin, Emily,Valente, Edward J.

, p. 193 - 205 (2019)

Abstract: Three methods for producing anhydrides of arylfuran and arylpyran pseudoacids were explored. These included thermal dehydration, phosgene or thionly chloride activation and decomposition, and dicyclohexylcarbodiimide activation and coupling. Derivatives of the cyclic forms of o-formylbenzoic acid, o-acetylbenzoic acid, 2-carboxyphenylacetaldehyde and of 4,4-dimethyl-3,4-dihydro-3-hydroxy-[1H]-isobenzopyran-1-one were formed including dipseudoanhydides and normal-pseudo anhydrides. Crystal and molecular structures for meso and (R,R/S,S)-bis(1[3H]-isobenzofuranone-3-yl)ether, (R,R/S,S)-bis(3-methyl-1[3H]-isobenzofuranone-3yl)ether, meso (3,4-dihydro-[1H]-isobenzopyran-1-one-3-yl)ether, 3-benzoyloxy-1[3H]-isobenzofuranone, 3-benzoyloxy-3-methyl-1[3H]isobenzofuranone, 3-(4′-nitrobenzoyloxy)-4,4-dimethyl-3,4-dihydro-[1H]-isobenzopyran-1-one, and (1[3H]-isobenzofuranone-3-yl)(4,4,dimethyl-3,4-dihydro-[1H]-isobenzopyran-1-one-3-yl)ether are reported. Endocyclic pseudoacyl C–O bonds are always longer than the exocyclic pseudoacyl C–O bonds. It is possible to refine the previously established C–O bond length dependencies on the pKa (of the conjugate acids) of the leaving groups for 3-substituted 1-[3H]-isobenzofuranones. Of six dipseudoanhydrides studied, conformations are found with exocyclic C–O(ether) linkages synclinal to the endocyclic C–O and away from the ring (exo conformation) in two meso structures, two of three RR/SS forms and in a chiral unsymmetrical form. An endo conformation is observed in one of the RR/SS forms. In three normal-pseudo anhydrides, both endo and exo conformations are observed. Graphic Abstract: Synthetic methods for formation of anhydrides of several arylfuran and arylpyran pseudoacids are described, and the pseudoacyl C–O bond length trends are determined for leaving groups spanning over 30 pKa units.[Figure not available: see fulltext.]

Palladium-catalyzed synthesis of 3-oxo-1,3-dihydro-1-isobenzofuranyl alkanoates from 2-bromobenzaldehyde and sodium alkanoates

Cho, Chan Sik,Baek, Dong Yeol,Shim, Sang Chul

, p. 289 - 291 (1999)

2-Bromobenzaldehyde reacts with sodium alkanoates in acetonitrile under carbon monoxide pressure in the presence of a catalytic amount of bis(triphenylphosphine)palladium(II) chloride to afford the corresponding 3- oxo-1,3-dihydro-1-isobenzofuranyl alkano

Synthesis of Enantioenriched Phthalide and Isoindolinone Derivatives from 2-Formylbenzoic Acid

Niedek, Dominik,Schuler, S?ren M.M.,Eschmann, Christian,Wende, Raffael C.,Seitz, Alexander,Keul, Felix,Schreiner, Peter R.

, p. 371 - 382 (2016/12/24)

Transformations of 2-formylbenzoic acid provide direct access to a series of heterocyclic organic compounds such as phthalides and isoindolinones. Here, we use (+)-cinchonine as a catalyst in conjunction with nonafluoro-tert-butanol as a hydrogen-bond donor to afford enantiomerically enriched acylated 3-hydroxyphthalides with up to 99% yield and 90% ee through dynamic kinetic resolution. Moreover, various 3-alkoxyphthalides as well as 2-alkyl-3-hydroxy-1-isoindolinones were synthesized from 2-formylbenzoic acid.

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