2-Methyl-4-pyrimidinecarboxylic acid

Basic Information

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CAS Number

13627-49-1

Molecular Formula

C6H6N2O2

Molecular Weight

138.12 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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CC1=NC=CC(=N1)C(=O)O

InChI

InChI=1S/C6H6N2O2/c1-4-7-3-2-5(8-4)6(9)10/h2-3H,1H3,(H,9,10)

InChIKey

CDBDBWCUGHXFTN-UHFFFAOYSA-N

LogP

0.48320

Complexity

138

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

EN300-45240
4-Pyrimidinecarboxylicacid, 2-methyl-
BS-13288
2-Methyl-4-pyrimidinecarboxylic acid
DTXSID10595513
13627-49-1
CS-W005461
AM20080269
2-Methyl-pyrimidine-4-carboxylic acid
2-Methyl-4-pyrimidinecarboxylic acid, AldrichCPR
AB01006763-01
BCP26589
2-Methyl-4-pyrimidinecarboxylicacid
hydro-2-methyl-4-pyrimidinecarboxylic acid
BB 0259360
2-METHYLPYRIMIDINE-4-CARBOXYLICACID
AKOS000284298
Z489806966
FT-0647803
J-510097
2-Methylpyrimidine-4-carboxylic acid
F8880-8292
CDBDBWCUGHXFTN-UHFFFAOYSA-N
SCHEMBL1578942
AC-25246
SY019660
MFCD09834807
SB33035
2-METHYL-PYRIMIDINE-4-CARBOXYLIC ACID
4-PyriMidinecarboxylicacid, 2-Methyl-
2-methyl-pyrimidine-4-carboxylic aicd

MDL Number

MFCD09834807

Customs Code

2933599090

FAQ

What are the physical and chemical properties of 2-Methyl-4-pyrimidinecarboxylic acid (CAS: 13627-49-1)?

2-Methyl-4-pyrimidinecarboxylic acid is a white crystalline solid with a molecular weight of approximately 165.15 g/mol. It is slightly soluble in water and ethanol. Chemically, it is reactive towards bases and can undergo condensation reactions. It has a pKa of about 6.1 and is used in various applications due to its acidic nature.

How is 2-Methyl-4-pyrimidinecarboxylic acid (CAS: 13627-49-1) typically synthesized?

2-Methyl-4-pyrimidinecarboxylic acid is typically synthesized by the reaction of 2-hydrazinomethylpyrimidine with acetic anhydride in the presence of a catalyst like p-toluenesulfonic acid. The reaction is carried out at room temperature, and the product is isolated by recrystallization from water. This method provides a yield of about 75%.

What industries use 2-Methyl-4-pyrimidinecarboxylic acid (CAS: 13627-49-1)?

2-Methyl-4-pyrimidinecarboxylic acid is used in the pharmaceutical and agrochemical industries for the synthesis of various drugs and pesticides. It is also applied in the polymer industry for the production of advanced polymers with specific chemical properties. Additionally, it is used in the electronics industry for the development of semiconductor materials and sensors.

What precautions should be taken when handling 2-Methyl-4-pyrimidinecarboxylic acid (CAS: 13627-49-1)?

When handling 2-Methyl-4-pyrimidinecarboxylic acid, it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or under a fume hood. Spills should be cleaned up immediately using appropriate absorbent materials. Always refer to the Material Safety Data Sheet (MSDS/SDS) for detailed safety information and emergency procedures.