Ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate

Basic Information

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CAS Number

19867-62-0

Molecular Formula

C13H15N3O2

Molecular Weight

245.28 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 Amines

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

109-112°C

SMILES

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CCOC(=O)C1=C(N(N=C1)CC2=CC=CC=C2)N

InChI

InChI=1S/C13H15N3O2/c1-2-18-13(17)11-8-15-16(12(11)14)9-10-6-4-3-5-7-10/h3-8H,2,9,14H2,1H3

InChIKey

SDKPSMKNXBQGQU-UHFFFAOYSA-N

LogP

1.6903

Topological Polar Surface Area

70.14 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

279

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

SCHEMBL4832108
SS-4747
FT-0712336
HMS1672H18
HMS2469L07
ethyl 5-amino-1-benzyl-pyrazole-4-carboxylate
BB 0219287
19867-62-0
5-Amino-1-benzyl-1H-pyrazole-4-carboxylic acid ethyl ester
SMR000116285
AKOS000260621
Z57683725
CHEMBL1557686
s10598
SDKPSMKNXBQGQU-UHFFFAOYSA-N
1H-Pyrazole-4-carboxylic acid, 5-amino-1-(phenylmethyl)-, ethyl ester
SB75079
MLS000525811
ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate
Oprea1_530508
UPCMLD0ENAT5756785:001
DTXSID00354878
F1727-0255
Oprea1_302968
Ethyl?5-amino-1-benzyl-1H-pyrazole-4-carboxylate
AB00095102-01
ethyl 5-amino-1-benzylpyrazole-4-carboxylate
MFCD00502757
A853263
EN300-71575
Ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate

MDL Number

MFCD00502757

Customs Code

2933199090

FAQ

What is Ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate (CAS: 19867-62-0)?

Ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate (CAS: 19867-62-0) is an organic compound with a molecular formula C12H12N3O3. It is characterized by its aromatic and amine functionalities. This compound is used in various applications including pharmaceuticals, where it may serve as an intermediate or active ingredient in the synthesis of other drugs.

What are the main uses of Ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate (CAS: 19867-62-0)?

Ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate (CAS: 19867-62-0) is primarily used in pharmaceutical applications as a precursor in the synthesis of medicinal compounds. It may also find use in research and development for the discovery of new drugs.

Is Ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate (CAS: 19867-62-0) safe?

Ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate (CAS: 19867-62-0) is generally safe when handled properly. However, it is important to follow all safety precautions, including the use of appropriate personal protective equipment (PPE) and working in a well-ventilated area. Exposure to high concentrations or prolonged exposure may cause irritation or other health effects. It is crucial to adhere to the guidelines provided by the Material Safety Data Sheet (MSDS) and local regulations.

How should Ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate (CAS: 19867-62-0) be stored?

Ethyl 5-amino-1-benzyl-1H-pyrazole-4-carboxylate (CAS: 19867-62-0) should be stored in a cool, dry place away from direct sunlight and heat sources. It is advisable to keep it in a tightly sealed, airtight container to prevent degradation and contamination. Store it at room temperature unless specified otherwise in the MSDS. Avoid storing in high humidity as it may affect the stability of the compound.