2-Methoxy-6-(trifluoromethyl)-4(1H)-pyrimidinone

Basic Information

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CAS Number

175354-56-0

Molecular Formula

C6H5F3N2O2

Molecular Weight

194.11 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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 Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

SMILES

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COc1nc(cc(=O)[nH]1)C(F)(F)F

InChI

InChI=1S/C6H5F3N2O2/c1-13-5-10-3(6(7,8)9)2-4(12)11-5/h2H,1H3,(H,10,11,12)

InChIKey

ILOOCRYHYUMTKL-UHFFFAOYSA-N

LogP

0.7972999999999999

Topological Polar Surface Area

54.98 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

293

Synonyms & References

English

2-Methoxy-6-(trifluoromethyl)pyrimidin-4(3H)-one
2-Methoxy-6-trifluoroMethyl-3H-pyriMidin-4-one
2-Methoxy-6-trifluoromethyl-pyrimidin-4-ol
2-Methoxy-6-trifluoromethyl-1H-pyrimidin-4-one
AK132968
2-methoxy-6-(trifluoromethyl)-1H-pyrimidin-4-one
FCH1687510
AB0069323
AX8254029
ST2417022
2-methoxy-6-(trifluoromethyl)pyrimidin-4-ol
Z4294
2-methoxy-6-(trifluorometh

MDL Number

MFCD16988116

FAQ

What are the physical and chemical properties of 2-Methoxy-6-(trifluoromethyl)-4(1H)-pyrimidinone (CAS: 175354-56-0)?

2-Methoxy-6-(trifluoromethyl)-4(1H)-pyrimidinone is a white crystalline solid. Its molecular weight is approximately 252.09 g/mol. It has low solubility in water but is soluble in organic solvents like methanol and acetonitrile. The compound is relatively stable but can react with bases to form pyrimidine derivatives. It is commonly used in organic synthesis and pharmaceuticals due to its reactivity and stability.

How is 2-Methoxy-6-(trifluoromethyl)-4(1H)-pyrimidinone (CAS: 175354-56-0) typically synthesized?

2-Methoxy-6-(trifluoromethyl)-4(1H)-pyrimidinone is typically synthesized by the reaction of 6-chloro-4(1H)-pyrimidinone with methoxy trifluoromethyl sulfonyl chloride in the presence of a base such as triethylamine. The reaction is carried out in an inert solvent like dichloromethane or tetrahydrofuran. The yield is around 85%, and the reaction is selective and efficient.

What industries use 2-Methoxy-6-(trifluoromethyl)-4(1H)-pyrimidinone (CAS: 175354-56-0)?

2-Methoxy-6-(trifluoromethyl)-4(1H)-pyrimidinone is used in various industries, including pharmaceuticals, where it serves as a precursor for the synthesis of antiviral and antifungal drugs. It is also utilized in the polymer industry for its chemical reactivity and stability in organic media. Additionally, it finds applications in the production of sensors and semiconductors.

What precautions should be taken when handling 2-Methoxy-6-(trifluoromethyl)-4(1H)-pyrimidinone (CAS: 175354-56-0)?

When handling 2-Methoxy-6-(trifluoromethyl)-4(1H)-pyrimidinone, it is important to use appropriate personal protective equipment (PPE) such as gloves, safety glasses, and a lab coat. Ensure the use of a fume hood to minimize inhalation risks. Handle the compound in a well-ventilated area to avoid exposure. Spills should be cleaned up immediately using appropriate absorbent materials, and the area should be ventilated thoroughly. Refer to the safety data sheet (SDS) for detailed handling and disposal instructions.