Cas no 1820-42-4 (4,4'-Dichlorodiphenylacetylene)

4,4'-Dichlorodiphenylacetylene structure
1820-42-4 structure
Product Name:4,4'-Dichlorodiphenylacetylene
CAS No:1820-42-4
MF:C14H8Cl2
MW:247.11932182312
CID:883437
PubChem ID:97372
Update Time:2025-07-20

4,4'-Dichlorodiphenylacetylene Chemical and Physical Properties

Names and Identifiers

    • 1,1''-ethyne-1,2-diylbis(4-chlorobenzene)
    • 1-chloro-4-[2-(4-chlorophenyl)ethynyl]benzene
    • #39-dichlorobenzil
    • 1,1'-ethyne-1,2-diylbis(4-chlorobenzene)
    • 1,2-bis
    • 1,2-BIS-(4-CHLORO-PHENYL)-ETHANE-1,2-DIONE
    • 1,2-bis(4-chlorophenyl)ethanedione
    • 1,2-bis(4-chlorophenyl)ethyne
    • 1,2-bis(p-chlorophenyl)acetylene
    • 1,2-bis(p-chlorophenyl)ethanedione
    • 1,2-di(4-chlorophenyl)-1,2-ethanedione
    • 4,4&amp
    • Bis(4-chlorophenyl) diketone
    • bis(4-chlorophenyl)ethanedione
    • Di(4-chlorophenyl) diketone
    • di(4-chlorophenyl)acetylene
    • p,p'-Dichlorobenzil
    • Bis(4-Chlorophenyl)Acetylene
    • 4,4'-Dichlorodiphenylacetylene
    • QFRLNLXZHMUYHO-UHFFFAOYSA-N
    • HS-5782
    • DTXSID80171227
    • G65452
    • SCHEMBL719360
    • 1820-42-4
    • Bis[p-chlorophenyl]acetylene
    • Benzene, 1,1'-(1,2-ethynediyl)bis(4-chloro-
    • NSC-118857
    • dichlorotolan
    • NSC118857
    • NSC 118857
    • CS-0210726
    • 1-Chloro-4-[(4-chlorophenyl)ethynyl]benzene #
    • Inchi: 1S/C14H8Cl2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10H
    • InChI Key: QFRLNLXZHMUYHO-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(C#CC2C=CC(=CC=2)Cl)=CC=1

Computed Properties

  • Exact Mass: 246.00044
  • Monoisotopic Mass: 246.0003056g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 244
  • 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: 5.2
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • PSA: 0
  • LogP: 4.39320

4,4'-Dichlorodiphenylacetylene Pricemore >>

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Additional information on 4,4'-Dichlorodiphenylacetylene

Comprehensive Overview of 4,4'-Dichlorodiphenylacetylene (CAS No. 1820-42-4): Properties, Applications, and Industry Insights

4,4'-Dichlorodiphenylacetylene (CAS No. 1820-42-4) is a specialized organic compound widely recognized for its unique molecular structure and versatile applications in advanced material science and chemical synthesis. This aromatic acetylene derivative features two chlorine atoms symmetrically positioned on a diphenylacetylene backbone, contributing to its distinct physicochemical properties. As industries increasingly seek high-performance intermediates for optoelectronics and polymer engineering, this compound has garnered significant attention due to its thermal stability and cross-coupling reactivity.

The growing demand for 4,4'-Dichlorodiphenylacetylene aligns with trends in OLED technology and conjugated polymer development, where users frequently search for "synthesis of diphenylacetylene derivatives" or "chlorinated aromatic compounds for organic semiconductors." Researchers value its role as a building block in Suzuki-Miyaura and Sonogashira couplings, critical for constructing π-conjugated systems in organic photovoltaic materials. Recent studies highlight its potential in designing liquid crystal displays (LCDs), addressing the surge in queries about "advanced materials for flexible electronics."

From a synthetic chemistry perspective, CAS 1820-42-4 exhibits remarkable stereoelectronic effects due to the rigid linear geometry of its acetylene spacer. This property makes it invaluable for creating molecular wires and coordination polymers, topics trending in nanotechnology forums. Analytical techniques like HPLC purification and NMR characterization are essential for quality control, reflecting common search terms such as "how to analyze dichlorodiphenylacetylene purity." Environmental considerations have also prompted investigations into green synthesis routes for this compound, responding to industry demands for sustainable chemistry practices.

The commercial significance of 4,4'-Dichlorodiphenylacetylene is evident in patent filings related to photoactive materials and electroluminescent devices. Suppliers often optimize storage conditions (typically under inert gas) to preserve its crystalline form, a frequent concern among buyers searching for "stable acetylene derivatives suppliers." With melting points around 150-155°C and solubility in common organic solvents, it remains a practical choice for laboratory-scale and industrial applications alike.

Emerging research explores modifications of the dichlorodiphenylacetylene core for metal-organic frameworks (MOFs), capitalizing on its ability to coordinate with transition metals. This aligns with growing interest in "porous materials for gas storage" across scientific databases. Regulatory-compliant handling protocols ensure safe utilization while maintaining compliance with global chemical standards, though it's classified as non-hazardous under normal use conditions.

Future prospects for CAS 1820-42-4 include potential applications in quantum dot sensitization and molecular electronics, areas generating substantial academic and commercial inquiry. As the chemical industry prioritizes tailor-made intermediates, this compound's balanced reactivity and structural predictability position it as a key player in next-generation material innovation.

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