2-Methoxy-3-(1-methyl-1H-1,2,4-triazol-3-yl)aniline

Basic Information

View in Editor

CAS Number

1609394-10-6

Molecular Formula

C10H12N4O

Molecular Weight

204.23 g/mol

Chemical Classification

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

Basic Physical Properties

SMILES

View in Editor

COc1c(N)cccc1c2ncn(C)n2

InChI

InChI=1S/C10H12N4O/c1-14-6-12-10(13-14)7-4-3-5-8(11)9(7)15-2/h3-6H,11H2,1-2H3

InChIKey

FIAZRZSVFOMYSD-UHFFFAOYSA-N

LogP

1.0729

Topological Polar Surface Area

65.96000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

214

Synonyms & References

English

2-methoxy-3-(1-methyl-1H-1,2,4-triazol-3-yl)aniline
FIAZRZSVFOMYSD-UHFFFAOYSA-N
SY253865
2-methoxy-3-(1-methyl-1,2,4-triazol-3-yl)aniline
2-Methoxy-3-(1-methyl-1H-[1,2,4]triazol-3-yl)-phenylamine

MDL Number

MFCD30489435

FAQ

What are the physical and chemical properties of 2-Methoxy-3-(1-methyl-1H-1,2,4-triazol-3-yl)aniline (CAS: 1609394-10-6)?

2-Methoxy-3-(1-methyl-1H-1,2,4-triazol-3-yl)aniline (CAS: 1609394-10-6) is a crystalline solid with a molecular weight of approximately 241.23 g/mol. It has a low solubility in water (0.12 g/100 mL at 20°C) but is more soluble in organic solvents like ethanol and acetone. This compound is known for its basic nature and can react with acids to form salts. It is stable under normal conditions but should be handled in a fume hood to avoid inhalation and skin contact.

How is 2-Methoxy-3-(1-methyl-1H-1,2,4-triazol-3-yl)aniline (CAS: 1609394-10-6) typically synthesized?

2-Methoxy-3-(1-methyl-1H-1,2,4-triazol-3-yl)aniline (CAS: 1609394-10-6) can be synthesized through a multi-step process involving the reaction of an aniline derivative with a 1,2,4-triazole derivative. This typically involves coupling reactions and subsequent methylation steps. The reaction is catalyzed by an appropriate reagent and proceeds with good selectivity and yield, making it a feasible method for laboratory and industrial production.

What industries use 2-Methoxy-3-(1-methyl-1H-1,2,4-triazol-3-yl)aniline (CAS: 1609394-10-6)?

2-Methoxy-3-(1-methyl-1H-1,2,4-triazol-3-yl)aniline (CAS: 1609394-10-6) is used in the pharmaceutical industry for the synthesis of certain drug intermediates. It also finds applications in the development of sensors and in the preparation of materials for the semiconductor industry due to its electronic properties. Additionally, it can be used in the preparation of organic coatings and polymers.

What precautions should be taken when handling 2-Methoxy-3-(1-methyl-1H-1,2,4-triazol-3-yl)aniline (CAS: 1609394-10-6)?

When handling 2-Methoxy-3-(1-methyl-1H-1,2,4-triazol-3-yl)aniline (CAS: 1609394-10-6), it is important to use appropriate personal protective equipment (PPE), including gloves and a lab coat. The compound should be handled in a well-ventilated area or fume hood to avoid inhalation. Spills should be cleaned up using appropriate absorbent materials, and the area should be flushed with water. Always refer to the Safety Data Sheet (SDS) for detailed information on safe handling and storage.