Ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate

Basic Information

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CAS Number

81153-64-2

Molecular Formula

C13H14N2O2

Molecular Weight

230.27 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

Melting Point

128 - 130°C

Boiling Point

128-130°C/2.25mm

Density

1.13

Refractive Index

1.568

SMILES

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CCOC(=O)C1=NN(C(=C1)C)C2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2/c1-3-17-13(16)12-9-10(2)15(14-12)11-7-5-4-6-8-11/h4-9H,3H2,1-2H3

InChIKey

YBPIMHCENGHGMJ-UHFFFAOYSA-N

LogP

2.3574200000000003

Topological Polar Surface Area

44.12 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

Ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate
ETHYL 5-METHYL-1-PHENYLPYRAZOLE-3-CARBOXYLATE
5-METHYL-1-PHENYL-1H-PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER
3-ethoxycarbonyl-1-phenyl-5-methylpyrazole
5-Methyl-1-phenyl-1H-pyrazol-3-carbonsaeure-aethylester
5-methyl-1-phenyl-pyrazole-3-carboxylic acid ethyl ester
ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate

MDL Number

MFCD00221427

Customs Code

2933199090

FAQ

What regulatory guidelines apply to Ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate (CAS: 81153-64-2)?

Ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate (CAS: 81153-64-2) is subject to regulatory guidelines under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations in the European Union, and FDA/EPA requirements for chemical substances. It is classified as a hazardous substance based on its physical and chemical properties, and safety data sheets (SDS) must be provided for workplace exposure and handling.

Are there alternatives to Ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate (CAS: 81153-64-2) in synthesis?

There are several alternatives to Ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate (CAS: 81153-64-2) in synthesis, including related compounds like Ethyl 1-phenyl-1H-pyrazole-3-carboxylate and Ethyl 5-ethyl-1-phenyl-1H-pyrazole-3-carboxylate. These alternatives can serve similar functions in various chemical reactions and can be used as substitutes based on specific requirements and availability.

What is the market or research trend for Ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate (CAS: 81153-64-2)?

The market for Ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate (CAS: 81153-64-2) is driven by its applications in pharmaceuticals and agrochemicals. Research trends indicate an increasing interest in its potential as a lead compound for drug development. Market dynamics suggest growing demand, especially in regions with robust pharmaceutical industries.

How should waste containing Ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate (CAS: 81153-64-2) be handled?

Waste containing Ethyl 5-methyl-1-phenyl-1H-pyrazole-3-carboxylate (CAS: 81153-64-2) should be managed according to hazardous waste regulations. Waste liquid should be collected in appropriate containers, and the waste should be disposed of through incineration by a professional waste disposal company. Environmental protection precautions must be taken to prevent contamination of soil and water during disposal.