3041-17-6

Basic information

• Product Name: 1-Benzoxepin-2(3H)-one, 4,5-dihydro-
• CAS NO: 3041-17-6
• Molecular Formula: C10H10O2
• Molecular Weight: 162.188
• Mol File: 3041-17-6.mol
• Article Data: 3

Chemical Properties

• CAS DataBase Reference: 1-Benzoxepin-2(3H)-one, 4,5-dihydro-(CAS DataBase Reference)
• NIST Chemistry Reference: 1-Benzoxepin-2(3H)-one, 4,5-dihydro-(3041-17-6)
• EPA Substance Registry System: 1-Benzoxepin-2(3H)-one, 4,5-dihydro-(3041-17-6)

Safety Data

• Hazardous Substances Data: 3041-17-6(Hazardous Substances Data)

Usage

Cyclic Compound

Yes

Explanation

1-Benzoxepin-2(3H)-one, 4,5-dihydrois a cyclic compound, meaning its atoms are arranged in a closed loop or ring.

Explanation

The cyclic structure of this compound consists of a six-membered ring, which includes both carbon and oxygen atoms.

Explanation

The compound contains both oxygen and carbon atoms in its structure, contributing to its unique properties and potential applications.

Explanation

Studies have shown that 1-Benzoxepin-2(3H)-one, 4,5-dihydrohas antiproliferative and anticancer properties, making it a candidate for further research and development in the pharmaceutical industry.

Explanation

Due to its unique structure, this compound can be used as a building block in the synthesis of other organic compounds, potentially leading to the development of novel compounds with various applications.

Explanation

The specific industrial applications of 1-Benzoxepin-2(3H)-one, 4,5-dihydromay vary depending on its specific properties and the context in which it is used. Further research and development could reveal new industrial uses for this compound.

Explanation

The properties and uses of 1-Benzoxepin-2(3H)-one, 4,5-dihydrocan differ based on the specific application and context in which it is employed. This means that its potential benefits and limitations may change depending on the situation.

Ring Size

Six-membered

Oxygen and Carbon Atoms

Present

Potential Pharmaceutical Applications

Yes

Building Block in Organic Synthesis

Yes

Industrial Applications

Potential

Specific Properties and Uses

Vary by Application

Upstream product

• 294669-29-7 2-(2-hydroxyphenyl)cyclobutanone 
• 201230-82-2 carbon monoxide 
• 1745-81-9 o-Allylphenol 
• 1821-12-1 4-Phenylbutyric acid 

Downstream Products

• 35387-19-0 2-hydroxybenzenebutanoic acid 
• 28315-93-7 5-Hydroxy-1-tetralone 
• 93108-07-7 methyl 4-(2-hydroxyphenyl)-butyrate 
• 1427500-17-1 methyl 4-(3-bromo-2-hydroxyphenyl)butanoate 
• 88430-50-6 beraprost 
• 55089-05-9 4-(o-hydroxyphenyl)butanal 
• 51796-02-2 5-(2-hydroxyphenyl)-1-pentene 
• 1360546-23-1 (E)-ethyl 3-(2-(4-(dibenzylamino)-4-thioxobutyl)phenyl)acrylate 

Relevant articles and documents

PdI2-catalyzed regioselective cyclocarbonylation of 2-allyl phenols to dihydrocoumarins

A simple, efficient, and regioselective synthesis of 3-methyl-3,4-dihydrocoumarins is reported. The reaction of 2-allyl phenols with synthesis gas was catalyzed by PdI2, and 1,3,5,7-tetramethyl-6-phenyl-2,4,8-trioxa-6-phosphaadamantane (L1) and 1,3,5,7-tetramethyl-6-tetradecyl-2,4,8-trioxa-6-phosphaadamantane (L2) were effective as ligands, affording good product selectivity in all cases.

Lactone formation by rhodium-catalyzed C-C bond cleavage of cyclobutanone

As a coordinating ligand, the phenol group in appropriately substituted cyclobutanones facilitates the Rh1-catalyzed activation of the C-C bond between the carbonyl group and the α-carbon atom. This novel reaction leads, depending on the position of the phenol group on the cyclobutanone ring, to lactones of varying ring size (for example, as shown for a seven-membered-ring lactone).