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3-Methyl-1H-pyrazole-5-carboxylic acid

1H-Pyrazole-3-carboxylicacid, 5-methyl-

CAS: 402-61-9;696-22-0

Molecular Formula: C5H6N2O2

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3-Methyl-1H-pyrazole-5-carboxylic acid - Names and Identifiers

Name 1H-Pyrazole-3-carboxylicacid, 5-methyl-
Synonyms 3-Methyl-5-pyrazolecarboxylic acid
5-methylpyrazole-3-carboxylic acid
Pyrazole-5-carboxylic acid, 3-methyl-
Pyrazole-3-carboxylic acid, 5-methyl-
3-METHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID
3-methyl-1H-pyrazole-5-carboxylic acid
5-Methyl-1H-pyrazole-3-carboxylic acid
1H-Pyrazole-3-carboxylicacid, 5-methyl-
1H-Pyrazole-3-carboxylic acid, 5-Methyl-
5(or 3)-Methyl-pyrazole-3(or 5)-carboxylic Acid
CAS 402-61-9
696-22-0
EINECS 206-953-0
InChI InChI=1/C5H6N2O2/c1-3-2-4(5(8)9)7-6-3/h2H,1H3,(H,6,7)(H,8,9)

3-Methyl-1H-pyrazole-5-carboxylic acid - Physico-chemical Properties

Molecular FormulaC5H6N2O2
Molar Mass126.11
Density1.404 g/cm3
Melting Point236-240℃
Boling Point388.8 °C at 760 mmHg
Flash Point188.9 °C
Vapor Presure9.69E-07mmHg at 25°C
Storage Condition2-8°C
Refractive Index1.595

3-Methyl-1H-pyrazole-5-carboxylic acid - Risk and Safety

Hazard SymbolsXi - Irritant
Irritant
Risk CodesR36/37/38 - Irritating to eyes, respiratory system and skin.
Safety DescriptionS26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S37/39 - Wear suitable gloves and eye/face protection

3-Methyl-1H-pyrazole-5-carboxylic acid - Introduction

It is an organic compound with the chemical formula C5H5N2O2. It is typically a colorless to pale yellow crystalline solid.

The compound has two functional groups, one is a pyrazole ring and the other is a carboxylic acid functional group. It has moderate solubility and is soluble in water and common organic solvents. The methyl group in its structure makes it hydrophobic.

As a heterocyclic compound, 5-methyl-has a variety of biological activities. It is widely used in pharmaceutical research and drug synthesis, often as a raw material or intermediate. Specific applications include the synthesis of vitamin B1 analogs, insecticides, plavix inhibitors (a compound used to inhibit plant growth), and the like.

Preparation, 5-methyl-can be obtained by reacting the nitrogen atom of the pyrazole ring with a methylating agent (e. g. methyl iodide). This method is carried out by an N-methylation reaction, the common method being the reaction of the corresponding nucleophile with an N-methyl reagent.
Last Update:2024-04-09 02:00:45
3-Methyl-1H-pyrazole-5-carboxylic acid
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CAS: 696-22-0
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3-Methyl-1H-pyrazole-5-carboxylic acid
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