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1-Benzoxepin-2(3H)-one, octahydro- is a chemical compound with the molecular formula C9H16O2. It belongs to the class of benzoxepin derivatives, which are heterocyclic compounds containing a benzene ring fused to an oxepane ring. This specific compound features a seven-membered oxepane ring with an oxygen atom and a six-membered benzene ring, with a ketone functional group (C=O) at the 2-position. The octahydro prefix indicates that the compound has undergone hydrogenation, resulting in fully saturated carbon-carbon bonds throughout the structure. This chemical is primarily used in the synthesis of various pharmaceuticals and agrochemicals due to its unique ring system and reactivity.

4441-65-0

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4441-65-0 Usage

General Description

1-Benzoxepin-2(3H)-one, octahydro- is a chemical compound that is also known as octahydro-1H-benz[f]isoquinoline-5,9-dione. It is a heterocyclic compound with a unique bicyclic structure that consists of a benzene ring fused to a seven-membered oxygen-containing ring. 1-Benzoxepin-2(3H)-one, octahydro- has potential applications in the pharmaceutical industry, particularly in the development of novel therapeutic agents. Its molecular structure and properties make it an interesting target for drug discovery efforts, and it may have biological activities that make it suitable for further study in the context of medicinal chemistry and pharmacology.

Check Digit Verification of cas no

The CAS Registry Mumber 4441-65-0 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,4,4 and 1 respectively; the second part has 2 digits, 6 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 4441-65:
(6*4)+(5*4)+(4*4)+(3*1)+(2*6)+(1*5)=80
80 % 10 = 0
So 4441-65-0 is a valid CAS Registry Number.

4441-65-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-(2'-hydroxycyclohexyl)butanoic acid lactone

1.2 Other means of identification

Product number -
Other names -

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:4441-65-0 SDS

4441-65-0Upstream product

4441-65-0Downstream Products

4441-65-0Relevant academic research and scientific papers

5-CYCLOPENTYL-5-HYDROXYPENTANOIC AND 4-(2'-HYDROXYCYCLOHEXYL)-BUTANOIC ACIDS LACTONES OBTENTION BY ANODIC OXIDATION OF 1-DECALONE

Barba, Fructuoso,Guirado, Antonio,Barba, Isidoro,Lopez, Marcelo

, p. 463 - 464 (1982)

The 1-decalone anodic oxidation products in alkaline hydroalcoholic medium with platinum anode are identified.The 5-cyclopentyl-5-hydroxypentanoic acid lactone formation evidence a ring contraction process through a carbocationic intermediate.

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