Ethyl 2-(quinolin-2-YL)acetate

Basic Information

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CAS Number

5100-57-2

Molecular Formula

C13H13NO2

Molecular Weight

215.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CCOC(=O)CC1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C13H13NO2/c1-2-16-13(15)9-11-8-7-10-5-3-4-6-12(10)14-11/h3-8H,2,9H2,1H3

InChIKey

OQQYMAOGIWMABG-UHFFFAOYSA-N

LogP

2.3404

Topological Polar Surface Area

39.19 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

242

Synonyms & References

English

Ethyl 2-(quinolin-2-yl)acetate
ethyl 2-quinolin-2-ylacetate
ethyl quinaldinate
2-quinolineacetic acid ethyl ester
MFCD03002579
2-QUINOLINEACETIC ACID, ETHYL ESTER
A871399
OQQYMAOGIWMABG-UHFFFAOYSA-N
AS-42106
DB-351334
Ethyl (quinolin-2-yl)acetate
CS-D0121
5100-57-2
QUINOLIN-2-YL-ACETIC ACID ETHYL ESTER
ethyl quinolin-2-ylacetate
AKOS015854248
ETHYL 2-(QUINOLIN-2-YL)ACETATE
Quinolin-2-ylacetic acid ethyl ester
SCHEMBL4728631
DTXSID30499887
SY240097
AB12950
Ethyl2-(quinolin-2-yl)acetate

MDL Number

MFCD03002579

Customs Code

2933499090

FAQ

What regulatory guidelines apply to Ethyl 2-(quinolin-2-YL)acetate (CAS: 5100-57-2)?

Ethyl 2-(quinolin-2-YL)acetate (CAS: 5100-57-2) falls under the scope of the REACH regulations for chemicals placed on the European market. It is also subject to GHS classification, requiring appropriate labels and safety data sheets. For FDA and EPA, it is advisable to check current regulations, as it may be regulated as a hazardous substance based on its properties. Detailed handling and disposal procedures should comply with local and national environmental protection standards.

Are there alternatives to Ethyl 2-(quinolin-2-YL)acetate (CAS: 5100-57-2) in synthesis?

There are several alternatives to Ethyl 2-(quinolin-2-YL)acetate (CAS: 5100-57-2) in synthesis. Common substitute reagents include methyl 2-(quinolin-2-YL)acetate and other related esters. These can provide similar functional groups and properties for different applications. Additionally, synthetic routes can be adjusted to use safer or more environmentally friendly reagents as alternatives.

What is the market or research trend for Ethyl 2-(quinolin-2-YL)acetate (CAS: 5100-57-2)?

The market for Ethyl 2-(quinolin-2-YL)acetate (CAS: 5100-57-2) is driven by its use in pharmaceuticals and as a precursor in organic synthesis. Research trends are focusing on its application in medicinal chemistry and as a potential scaffold for drug development. Market trends also reflect growing interest in alternative synthesis methods and the development of more sustainable chemistry practices.

How should waste containing Ethyl 2-(quinolin-2-YL)acetate (CAS: 5100-57-2) be handled?

Waste containing Ethyl 2-(quinolin-2-YL)acetate (CAS: 5100-57-2) should be collected in appropriate containers and stored under conditions that prevent spills or leaks. Prior to disposal, it is recommended to neutralize the waste and ensure it meets local environmental protection standards. Incineration or professional waste disposal services should be used, ensuring that all waste management practices comply with regulatory requirements to minimize environmental impact.