Cas no 859932-64-2 (Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1))

Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) is a chlorinated aromatic aldehyde hydrate with applications in organic synthesis and pharmaceutical intermediates. Its key structural features include a reactive aldehyde group and a chloro-substituted aromatic ring, making it a versatile building block for further chemical modifications. The hydrate form enhances stability and handling, reducing volatility compared to the anhydrous counterpart. This compound is particularly useful in the synthesis of fine chemicals and active pharmaceutical ingredients (APIs), where precise functional group reactivity is required. Its well-defined composition ensures consistent performance in synthetic workflows, supporting reproducibility in research and industrial processes.
Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) structure
859932-64-2 structure
Product Name:Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1)
CAS No:859932-64-2
MF:C8H7ClO3
MW:186.592381715775
CID:718094
PubChem ID:15556731
Update Time:2025-11-02

Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) Chemical and Physical Properties

Names and Identifiers

    • Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1)
    • 4-chlorophenylglyoxal hydrate
    • (4-Chlorophenyl)(oxo)acetaldehyde hydrate (1:1)
    • Glyoxal, (p-chlorophenyl)-, hydrate
    • SY122335
    • MFCD08272327
    • AKOS015855492
    • AB44429
    • 2-(4-chlorophenyl)-2-oxoacetaldehydehydrate
    • 2-(4-chlorophenyl)-2-oxoacetaldehyde;hydrate
    • CS-0062429
    • FT-0695492
    • 2-(4-chlorophenyl)-2-oxoacetaldehyde hydrate
    • 859932-64-2
    • 2-Amino-4-(trifluoromethyl)phenylaceticacid
    • AMY31336
    • 4-chlorophenyl glyoxal hydrate
    • FT-0647143
    • SCHEMBL10353718
    • A898761
    • 4-chlorophenylglyoxal monohydrate
    • GS-4325
    • 4996-21-8
    • DB-260039
    • MDL: MFCD08272327
    • Inchi: 1S/C8H5ClO2.H2O/c9-7-3-1-6(2-4-7)8(11)5-10;/h1-5H;1H2
    • InChI Key: JTOCXCVDVKZPEB-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(C(C=O)=O)=CC=1.O

Computed Properties

  • Exact Mass: 186.00800
  • Monoisotopic Mass: 186.0083718g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 160
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 35.1?2

Experimental Properties

  • Melting Point: 122 °C
  • PSA: 43.37000
  • LogP: 1.65730

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Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) Suppliers

Amadis Chemical Company Limited
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(CAS:859932-64-2)Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1)
Order Number:A898761
Stock Status:in Stock
Quantity:5g/25g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 12:02
Price ($):228.0/797.0

Additional information on Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1)

Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) (CAS No. 859932-64-2): A Comprehensive Overview

Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) (CAS No. 859932-64-2) is a specialized organic compound that has garnered significant interest in various chemical and industrial applications. This compound, characterized by its unique molecular structure, plays a crucial role in synthetic chemistry and material science. Its hydrate form ensures stability and ease of handling, making it a preferred choice for researchers and manufacturers alike.

The chemical structure of Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) features a chloro-substituted benzene ring attached to an acetaldehyde moiety, with an additional oxo group and a water molecule in its hydrate form. This configuration imparts distinct reactivity and solubility properties, which are highly valued in organic synthesis. The presence of the chloro group enhances its electrophilic character, enabling it to participate in various nucleophilic substitution reactions.

One of the most notable applications of Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) is in the synthesis of pharmaceutical intermediates. Researchers have utilized this compound to develop novel drug candidates, particularly in the fields of anti-inflammatory and antimicrobial agents. Its ability to act as a building block for complex molecules makes it indispensable in medicinal chemistry. Additionally, its hydrate form ensures better solubility in aqueous systems, facilitating its use in biological assays.

In the realm of material science, Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) has been explored for its potential in creating advanced polymers and coatings. The oxo group in its structure allows for cross-linking reactions, which are essential for producing durable and high-performance materials. This has led to its adoption in industries such as automotive, aerospace, and electronics, where robust and lightweight materials are in high demand.

The market dynamics for Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) reflect its growing importance. With increasing investments in green chemistry and sustainable synthesis, there is a rising demand for compounds that offer both efficiency and environmental compatibility. This compound, with its hydrate form and versatile reactivity, aligns well with these trends. Manufacturers are focusing on optimizing production processes to meet the needs of pharmaceutical and material science sectors.

From a safety and handling perspective, Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) requires standard laboratory precautions. Its hydrate form reduces volatility, minimizing inhalation risks. However, proper personal protective equipment (PPE) such as gloves and goggles should always be used when handling this compound. Storage recommendations include keeping it in a cool, dry place away from direct sunlight to maintain its stability.

Recent advancements in analytical techniques have enabled more precise characterization of Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1). Techniques such as NMR spectroscopy, mass spectrometry, and X-ray crystallography have provided deeper insights into its molecular interactions and reactivity. These tools are invaluable for researchers aiming to unlock new applications for this compound.

Looking ahead, the future of Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) appears promising. As industries continue to prioritize innovation and sustainability, the demand for specialized compounds like this one is expected to grow. Its role in drug discovery and advanced materials will likely expand, driven by ongoing research and development efforts. For those interested in exploring its potential, staying updated with the latest scientific literature and market reports is highly recommended.

In summary, Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1) (CAS No. 859932-64-2) is a versatile and valuable compound with wide-ranging applications. Its unique chemical properties, combined with its hydrate stability, make it a standout choice for researchers and industries alike. Whether in pharmaceuticals, material science, or beyond, this compound continues to demonstrate its significance in modern chemistry.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:859932-64-2)Benzeneacetaldehyde,4-chloro-a-oxo-, hydrate (1:1)
A898761
Purity:99%/99%
Quantity:5g/25g
Price ($):228.0/797.0
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