Cas no 1261891-18-2 (4-(2-Chlorophenyl)-2-cyanophenol)

4-(2-Chlorophenyl)-2-cyanophenol is a substituted phenolic compound featuring a chlorophenyl group and a cyano functional group on the aromatic ring. This structure imparts unique reactivity, making it a valuable intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. The presence of both electron-withdrawing (cyano) and electron-donating (hydroxyl) groups enhances its versatility in coupling reactions and heterocycle formation. Its high purity and stability under standard conditions ensure consistent performance in synthetic applications. The compound is typically handled under controlled conditions due to its functional group sensitivity, requiring appropriate storage and handling protocols.
4-(2-Chlorophenyl)-2-cyanophenol structure
1261891-18-2 structure
Product Name:4-(2-Chlorophenyl)-2-cyanophenol
CAS No:1261891-18-2
MF:C13H8ClNO
MW:229.661722183228
MDL:MFCD18314249
CID:2761602
PubChem ID:53219925
Update Time:2025-06-28

4-(2-Chlorophenyl)-2-cyanophenol Chemical and Physical Properties

Names and Identifiers

    • MFCD18314249
    • 2'-Chloro-4-hydroxy[1,1'-biphenyl]-3-carbonitrile
    • 1261891-18-2
    • DTXSID90684717
    • AKOS017557831
    • 4-(2-Chlorophenyl)-2-cyanophenol, 95%
    • 4-(2-CHLOROPHENYL)-2-CYANOPHENOL
    • 4-(2-Chlorophenyl)-2-cyanophenol
    • MDL: MFCD18314249
    • Inchi: 1S/C13H8ClNO/c14-12-4-2-1-3-11(12)9-5-6-13(16)10(7-9)8-15/h1-7,16H
    • InChI Key: MGKJJQCLBZAFNG-UHFFFAOYSA-N
    • SMILES: ClC1C=CC=CC=1C1C=CC(=C(C#N)C=1)O

Computed Properties

  • Exact Mass: 229.0294416Da
  • Monoisotopic Mass: 229.0294416Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 1
  • Complexity: 285
  • 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: 4.5
  • Topological Polar Surface Area: 44?2

4-(2-Chlorophenyl)-2-cyanophenol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB320292-5 g
4-(2-Chlorophenyl)-2-cyanophenol, 95%; .
1261891-18-2 95%
5g
€1159.00 2023-04-26
abcr
AB320292-5g
4-(2-Chlorophenyl)-2-cyanophenol, 95%; .
1261891-18-2 95%
5g
€1159.00 2025-04-21

Additional information on 4-(2-Chlorophenyl)-2-cyanophenol

4-(2-Chlorophenyl)-2-cyanophenol: A Comprehensive Overview

4-(2-Chlorophenyl)-2-cyanophenol is a chemical compound with the CAS number 1261891-18-2. This compound is a derivative of phenol, characterized by the presence of a chlorine atom at the 2-position of the phenyl ring and a cyano group at the 4-position. The structure of this compound is notable for its aromaticity and functional groups, which contribute to its unique chemical properties. Recent studies have highlighted its potential applications in various fields, including pharmaceuticals, agrochemicals, and advanced materials.

The synthesis of 4-(2-Chlorophenyl)-2-cyanophenol involves a multi-step process that typically begins with the chlorination of phenol derivatives. The introduction of the cyano group is achieved through nucleophilic substitution or other specialized reactions. Researchers have explored various synthetic pathways to optimize the yield and purity of this compound, with recent advancements focusing on green chemistry principles to minimize environmental impact.

One of the most significant areas of research involving 4-(2-Chlorophenyl)-2-cyanophenol is its application in drug discovery. The compound's ability to act as a scaffold for bioactive molecules has been extensively studied. For instance, recent findings suggest that it may exhibit anti-inflammatory and antioxidant properties, making it a promising candidate for therapeutic agents. Additionally, its role as an intermediate in the synthesis of more complex molecules has been documented in several peer-reviewed journals.

In the field of agrochemicals, 4-(2-Chlorophenyl)-2-cyanophenol has shown potential as a precursor for herbicides and fungicides. Its ability to interact with biological systems at molecular levels has been explored in recent studies, particularly in relation to pest control and crop protection. The compound's stability under various environmental conditions has also been tested, with results indicating its suitability for agricultural applications.

From a materials science perspective, 4-(2-Chlorophenyl)-2-cyanophenol has been investigated for its role in the development of advanced polymers and composites. Its aromatic structure and functional groups provide opportunities for creating materials with enhanced mechanical and thermal properties. Recent research has focused on its use in nanotechnology, where it serves as a building block for constructing nanostructured materials with applications in electronics and energy storage.

The physical and chemical properties of 4-(2-Chlorophenyl)-2-cyanophenol have been thoroughly characterized using modern analytical techniques. Its melting point, solubility, and reactivity under different conditions have been documented in detail. These properties are critical for understanding its behavior in various chemical reactions and industrial processes.

Moreover, the environmental impact of 4-(2-Chlorophenyl)-2-cyanophenol has been a topic of interest among researchers. Studies have been conducted to assess its biodegradability and toxicity levels. These findings are essential for ensuring safe handling and disposal practices in industrial settings.

In conclusion, 4-(2-Chlorophenyl)-2-cyanophenol (CAS No: 1261891-18-2) is a versatile compound with a wide range of applications across multiple disciplines. Its unique chemical structure and functional groups make it an invaluable tool in drug discovery, agrochemicals, and materials science. As research continues to uncover new potentials for this compound, it is expected to play an increasingly important role in advancing technological innovations.

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