4-Pyridineacrylic acid, methyl ester

Basic Information

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CAS Number

81124-49-4

Molecular Formula

C9H9NO2

Molecular Weight

163.18 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

Basic Physical Properties

SMILES

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COC(=O)C=CC1=CC=NC=C1

InChI

InChI=1S/C9H9NO2/c1-12-9(11)3-2-8-4-6-10-7-5-8/h2-7H,1H3/b3-2+

InChIKey

LDVKAIRVYWBGHI-NSCUHMNNSA-N

LogP

1.2677999999999998

Topological Polar Surface Area

39.19 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

171

Synonyms & References

English

2-Propenoic acid,3-(4-pyridinyl)-, methyl ester, (E)- (9CI)
METHYL-3-(4-PYRIDYL)ACRYLATE
SCHEMBL8865229
DTXSID201274298
Methyl-.beta.-(4-pyridyl)acrylate
4-Pyridinepropenoic acid methyl ester
methyl 3-(4-pyridyl)acrylate
Z3226989482
BS-17442
EN300-365199
(E)-Methyl 3-(pyridin-4-yl)acrylate
Acrylic acid, 3-(4-pyridyl)-, methyl ester
methyl (2E)-3-(pyridin-4-yl)prop-2-enoate
7340-34-3
81124-49-4
NSC 84239
Methyl-beta-(4-pyridyl)-acrylate
AT14565
WLN: T6NJ D1U1VO1
CS-0093846
methyl 3-(pyridin-4-yl)prop-2-enoate
Methyl 3-(pyridin-4-yl)acrylate
MFCD00023636
NSC-84239
CS-0166759
AKOS006227692
methyl (E)-3-(pyridin-4-yl)acrylate
Methyl (2E)-3-(4-pyridinyl)-2-propenoate
(E)-Methyl3-(pyridin-4-yl)acrylate
NSC84239
D75467

MDL Number

MFCD00023636

FAQ

What regulatory guidelines apply to 4-Pyridineacrylic acid, methyl ester (CAS: 81124-49-4)?

4-Pyridineacrylic acid, methyl ester (CAS: 81124-49-4) is subject to various regulatory guidelines, including GHS classification for hazardous chemicals. It falls under REACH regulations in the European Union, which require registration, evaluation, and authorization of chemicals. FDA and EPA have specific requirements for handling and disposal, particularly concerning environmental protection and health safety in the United States.

Are there alternatives to 4-Pyridineacrylic acid, methyl ester in synthesis?

There are alternative reagents and compounds that can be used in synthesis as substitutes for 4-Pyridineacrylic acid, methyl ester (CAS: 81124-49-4). For instance, 2-Pyridineacrylic acid methyl ester or other similar esters can serve as viable alternatives depending on the specific reaction conditions and desired end product properties.

What is the market or research trend for 4-Pyridineacrylic acid, methyl ester?

The market for 4-Pyridineacrylic acid, methyl ester (CAS: 81124-49-4) is driven by increasing demand in pharmaceuticals and agrochemicals. Research trends focus on its potential applications in drug synthesis and pesticide development. Additionally, there is growing interest in exploring its use in coatings and polymer chemistry, reflecting broader market dynamics and emerging trends in chemical research.

How should waste containing 4-Pyridineacrylic acid, methyl ester be handled?

Waste containing 4-Pyridineacrylic acid, methyl ester (CAS: 81124-49-4) should be handled carefully due to its potential environmental impact. Proper waste disposal should include collection in suitable containers, followed by incineration or professional waste disposal services that comply with local regulations. Environmental protection precautions, such as minimizing spillage and ensuring containment, are essential to prevent contamination.