Ethyl 4-(1H-pyrazol-1-yl)benzoate

Basic Information

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CAS Number

143426-47-5

Molecular Formula

C12H12N2O2

Molecular Weight

216.24 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

Flash Point

155.3℃

SMILES

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CCOC(=O)C1=CC=C(C=C1)N2C=CC=N2

InChI

InChI=1S/C12H12N2O2/c1-2-16-12(15)10-4-6-11(7-5-10)14-9-3-8-13-14/h3-9H,2H2,1H3

InChIKey

OJGQSNIJSFGVJG-UHFFFAOYSA-N

LogP

2.049

Topological Polar Surface Area

44.120000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

237

Synonyms & References

English

ethyl 4-pyrazol-1-ylbenzoate
Ethyl 4-(1-Pyrazolyl)benzoate
CS-0313703
Ethyl4-(1-Pyrazolyl)benzoate
SCHEMBL1363765
4-pyrazol-1-yl benzoic acid ethyl ester
DTXSID00359580
143426-47-5
Benzoic acid, 4-(1H-pyrazol-1-yl)-, ethyl ester
AMY16885
AKOS002310330
SY003680
A884933
AS-31562
OJGQSNIJSFGVJG-UHFFFAOYSA-N
ETHYL 4-(1H-PYRAZOL-1-YL)BENZOATE
FT-0721583
MFCD05994003
Ethyl 4-(1H-pyrazol-1-yl)benzoate
Benzoic acid,4-(1H-pyrazol-1-yl)-, ethyl ester
4-pyrazol-1-yl-benzoic acid ethyl ester
PubChem23695
ethyl 4-pyrazolylbenzoate
TRA0067679
4-pyrazol-1-yl benzoic ac
ethyl 4-(1H-pyrazol-1-yl)benzoate

MDL Number

MFCD05994003

Customs Code

2933199090

FAQ

What regulatory guidelines apply to Ethyl 4-(1H-pyrazol-1-yl)benzoate (CAS: 143426-47-5)?

Ethyl 4-(1H-pyrazol-1-yl)benzoate (CAS: 143426-47-5) is subject to various regulatory guidelines including the GHS (Globally Harmonized System) classification, REACH regulations in the EU, and FDA/EPA guidelines for its safe handling and environmental protection. Specific requirements include labeling, storage, and disposal methods to ensure compliance with local and international standards.

Are there alternatives to Ethyl 4-(1H-pyrazol-1-yl)benzoate (CAS: 143426-47-5) in synthesis?

Several alternatives to Ethyl 4-(1H-pyrazol-1-yl)benzoate (CAS: 143426-47-5) can be used in synthesis, such as other pyrazole derivatives or substituted benzoates. Common substitutes include ethyl 4-(1H-imidazol-1-yl)benzoate and ethyl 4-(1H-pyrazol-2-yl)benzoate, which offer similar functionalities and can be synthesized using analogous procedures.

What is the market or research trend for Ethyl 4-(1H-pyrazol-1-yl)benzoate (CAS: 143426-47-5)?

The market for Ethyl 4-(1H-pyrazol-1-yl)benzoate (CAS: 143426-47-5) is growing due to its use in pharmaceutical and chemical research. Research trends indicate increasing interest in its potential applications in drug discovery and synthesis of pharmaceutical intermediates. Additionally, there is a growing focus on its eco-friendly and sustainable synthesis methods.

How should waste containing Ethyl 4-(1H-pyrazol-1-yl)benzoate (CAS: 143426-47-5) be handled?

Waste containing Ethyl 4-(1H-pyrazol-1-yl)benzoate (CAS: 143426-47-5) should be collected in appropriate containers and stored separately. Proper incineration or professional waste disposal methods should be used, adhering to local environmental protection regulations. Precautions include ensuring the waste is in a dry state to prevent reactions and to minimize environmental impact.