Cas no 71406-68-3 (2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl-)

2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl-, is a substituted pyrimidine derivative with potential applications in pharmaceutical and agrochemical research. Its structure features a chloro group at the 4-position and dimethylamino and methyl substituents, contributing to its reactivity and versatility as an intermediate. This compound is particularly valuable in heterocyclic synthesis, where its functional groups enable selective modifications for the development of biologically active molecules. Its stability under standard conditions and well-defined reactivity profile make it a reliable building block for medicinal chemistry and material science applications. The compound is typically handled under controlled conditions to ensure purity and optimal performance in synthetic workflows.
2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl- structure
71406-68-3 structure
Product Name:2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl-
CAS No:71406-68-3
MF:C7H10ClN3
MW:171.627399921417
CID:1751703
PubChem ID:20284980
Update Time:2025-09-18

2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl- Chemical and Physical Properties

Names and Identifiers

    • 2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl-
    • DTXSID801269669
    • IUYMUWLYDYYIHH-UHFFFAOYSA-N
    • (4-Chloro-5-methyl-pyrimidin-2-yl)-dimethyl-amine
    • 4-Chloro-N,N,5-trimethylpyrimidin-2-amine
    • SCHEMBL4262711
    • 4-chloro-2-dimethylamino-5-methylpyrimidine
    • 4-Chloro-N,N,5-trimethyl-2-pyrimidinamine
    • DB-235109
    • SB56664
    • 71406-68-3
    • MDL: MFCD21098360
    • Inchi: 1S/C7H10ClN3/c1-5-4-9-7(11(2)3)10-6(5)8/h4H,1-3H3
    • InChI Key: IUYMUWLYDYYIHH-UHFFFAOYSA-N
    • SMILES: ClC1=C(C)C=NC(=N1)N(C)C

Computed Properties

  • Exact Mass: 171.0565
  • Monoisotopic Mass: 171.0563250g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 129
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 29?2

Experimental Properties

  • Density: 1.2±0.1 g/cm3
  • Boiling Point: 268.6±32.0 °C at 760 mmHg
  • Flash Point: 116.2±25.1 °C
  • PSA: 29.02
  • Vapor Pressure: 0.0±0.5 mmHg at 25°C

2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl- Security Information

2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl- Pricemore >>

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Additional information on 2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl-

Comprehensive Overview of 2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl- (CAS No. 71406-68-3)

2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl- (CAS No. 71406-68-3) is a specialized organic compound belonging to the pyrimidine family. This compound has garnered significant attention in recent years due to its unique chemical properties and potential applications in pharmaceuticals, agrochemicals, and material science. Researchers and industry professionals frequently search for terms like "4-chloro-N,N,5-trimethyl-2-pyrimidinamine uses" or "CAS 71406-68-3 synthesis", highlighting its growing relevance in scientific and industrial communities.

The molecular structure of 2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl- features a pyrimidine core substituted with chloro and dimethylamino groups at specific positions. This configuration imparts distinct reactivity, making it a valuable intermediate in organic synthesis. Recent studies have explored its role in developing novel heterocyclic compounds, a trending topic in medicinal chemistry. The compound's stability and solubility profile also make it suitable for various catalytic applications, another area of intense research interest.

In the pharmaceutical sector, derivatives of 2-Pyrimidinamine have shown promise in drug discovery programs. While the exact mechanism of action varies by derivative, the core structure's ability to interact with biological targets has led to investigations into potential therapeutic applications. This aligns with current healthcare trends focusing on targeted therapies and personalized medicine. Researchers often query "pyrimidine derivatives in drug development" or "4-chloro-N,N,5-trimethyl-2-pyrimidinamine biological activity", reflecting this interest.

From an industrial perspective, CAS 71406-68-3 has found utility in specialty chemical manufacturing. Its role as a building block for more complex molecules makes it valuable in producing advanced materials with specific optical or electronic properties. This connects with the growing demand for functional materials in electronics and renewable energy applications. The compound's potential in these areas has led to increased searches for "pyrimidine-based materials" and "organic electronic materials synthesis".

The synthesis of 2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl- typically involves multi-step organic reactions, with careful control of reaction conditions being crucial for optimal yield and purity. Recent advancements in green chemistry have prompted investigations into more sustainable production methods, addressing environmental concerns in chemical manufacturing. This aspect particularly resonates with current discussions about eco-friendly synthesis and process optimization in the chemical industry.

Analytical characterization of CAS 71406-68-3 employs various techniques including NMR spectroscopy, mass spectrometry, and HPLC. These methods ensure the compound meets stringent quality standards required for research and industrial applications. The growing importance of analytical method development for specialized compounds like this reflects broader trends in quality control and regulatory compliance across chemical industries.

Storage and handling of 4-chloro-N,N,5-trimethyl-2-pyrimidinamine require standard laboratory precautions. While not classified as hazardous under normal conditions, proper storage in cool, dry environments helps maintain its stability over extended periods. This practical consideration often appears in searches related to "chemical storage best practices" and "laboratory safety protocols".

The commercial availability of 2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl- has expanded in recent years, with multiple suppliers offering it in various quantities and purity grades. This availability supports its growing use across different research and development sectors. Market trends indicate increasing demand for such fine chemicals, driven by advancements in multiple scientific disciplines.

Future research directions for CAS 71406-68-3 may explore its potential in emerging fields such as nanotechnology or bioconjugation chemistry. These areas represent cutting-edge applications that could further enhance the compound's scientific and commercial value. Such possibilities align with current scientific inquiries about "next-generation chemical technologies" and "innovative material design".

In summary, 2-Pyrimidinamine, 4-chloro-N,N,5-trimethyl- (CAS No. 71406-68-3) represents an important chemical entity with diverse applications and significant research potential. Its relevance to current scientific trends and industrial needs ensures continued interest from both academic and commercial sectors. The compound's versatility and the growing body of research surrounding it position it as a valuable asset in modern chemistry and related fields.

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