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2-(ethylsulfanyl)ethyl 4-(4-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate is a complex organic compound with the molecular formula C25H28FNO3S. It is a derivative of quinoline, a heterocyclic compound with a benzene ring fused to a pyridine ring. This specific compound features a 4-fluorophenyl group attached to the quinoline core, a 5-oxo group indicating the presence of a carbonyl group, and a 3-carboxylate group. Additionally, it has a 2,7,7-trimethyl substitution pattern and a 2-(ethylsulfanyl)ethyl side chain. 2-(ethylsulfanyl)ethyl 4-(4-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate is likely to be found in pharmaceutical or chemical research due to its unique structure and potential applications in drug development or as a synthetic intermediate.

5727-11-7

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5727-11-7 Usage

Molecular weight

481.62 g/mol

Structure

The compound contains a hexahydroquinoline ring system with various substituents, including a sulfur-containing ethyl group, a carboxylate group, and a fluorophenyl group.

Substituents

The hexahydroquinoline ring has three methyl groups (trimethyl), a sulfur-containing ethyl group (ethylsulfanyl), and a fluorophenyl group (4-fluorophenyl).

Biological activity

The specific biological activities of 2-(ethylsulfanyl)ethyl 4-(4-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate are not mentioned in the material provided, but its unique structure may suggest potential applications in pharmaceuticals or agrochemicals.

Physical properties

The physical properties of 2-(ethylsulfanyl)ethyl 4-(4-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, such as solubility, melting point, and boiling point, are not provided in the material. However, these properties may be important for its potential applications.

Other potential applications

The unique structure of 2-(ethylsulfanyl)ethyl 4-(4-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate may suggest other potential applications beyond pharmaceuticals or agrochemicals, such as in materials science or as a precursor for other compounds.

Check Digit Verification of cas no

The CAS Registry Mumber 5727-11-7 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,7,2 and 7 respectively; the second part has 2 digits, 1 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 5727-11:
(6*5)+(5*7)+(4*2)+(3*7)+(2*1)+(1*1)=97
97 % 10 = 7
So 5727-11-7 is a valid CAS Registry Number.

5727-11-7SDS

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 2-ethylsulfanylethyl 4-(4-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate

1.2 Other means of identification

Product number -
Other names 2-(ethylsulfanyl)ethyl 4-(4-fluorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

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:5727-11-7 SDS

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