3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid

Basic Information

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CAS Number

796845-50-6

Molecular Formula

C7H10N2O2

Molecular Weight

154.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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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Cn1nccc1CCC(=O)O

InChI

InChI=1S/C7H10N2O2/c1-9-6(4-5-8-9)2-3-7(10)11/h4-5H,2-3H2,1H3,(H,10,11)

InChIKey

BNIMNWBBWQHMIM-UHFFFAOYSA-N

LogP

0.4373000000000001

Topological Polar Surface Area

55.120000000000005 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

3-(2-Methyl-2H-pyrazol-3-yl)-propionic acid
3-(1-METHYL-1H-PYRAZOL-5-YL)PROPANOIC ACID
3-(1-methyl-1H-pyrazol-5-yl)propanoic acid

MDL Number

MFCD06808507

FAQ

What is 3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid (CAS: 796845-50-6)?

3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid is a chemical compound with the CAS number 796845-50-6. It is a white or off-white solid with a molecular formula of C9H12N2O3. This compound has a distinctive odor and is used in various applications due to its chemical properties.

What are the main uses of 3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid (CAS: 796845-50-6)?

3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid is primarily used in the pharmaceutical industry as a precursor for the synthesis of other compounds. It also finds applications in the research field for developing new chemical entities and in the food industry as a flavor enhancer.

Is 3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid (CAS: 796845-50-6) safe?

3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid is generally considered safe, but it is important to follow safety guidelines. It is non-toxic and non-flammable, but exposure to high temperatures may cause decomposition. Protective measures include wearing gloves and goggles, and storing it in a cool, dry place away from direct sunlight.

How should 3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid (CAS: 796845-50-6) be stored?

3-(1-Methyl-1H-pyrazol-5-yl)propanoic acid should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. The storage temperature should be below 25°C to ensure stability and prevent decomposition.