Cas no 73575-54-9 (2,2',3,6,6'-Pentachlorobiphenyl)

2,2',3,6,6'-Pentachlorobiphenyl is a polychlorinated biphenyl (PCB) congener characterized by five chlorine substitutions at the 2, 2', 3, 6, and 6' positions of the biphenyl structure. This compound is primarily used in research and analytical applications as a reference standard for environmental and toxicological studies due to its persistence and bioaccumulative properties. Its well-defined chlorination pattern makes it valuable for chromatographic calibration and PCB contamination analysis. The compound’s stability and resistance to degradation allow for consistent performance in laboratory settings, facilitating the study of PCB behavior, metabolic pathways, and environmental impact. Proper handling is essential due to its potential toxicity and regulatory restrictions.
2,2',3,6,6'-Pentachlorobiphenyl structure
73575-54-9 structure
Product Name:2,2',3,6,6'-Pentachlorobiphenyl
CAS No:73575-54-9
MF:C12H5Cl5
MW:326.433098554611
CID:571281
PubChem ID:63089
Update Time:2025-11-02

2,2',3,6,6'-Pentachlorobiphenyl Chemical and Physical Properties

Names and Identifiers

    • 1,1'-Biphenyl,2,2',3,6,6'-pentachloro-
    • 2,2'3,6,6'-Pentachlorobiphenyl
    • 1,2,4-trichloro-3-(2,6-dichlorophenyl)benzene
    • Q27281931
    • QQFGAXUIQVKBKU-UHFFFAOYSA-N
    • 73575-54-9
    • 1,1'-Biphenyl, 2,2',3,6,6'-pentachloro-
    • SCHEMBL4447158
    • 2,2',3,6,6'-Pentachlorobiphenyl
    • K42VE4HVAP
    • PCB 96
    • 2,2',3,6,6'-Pentachloro-1,1'-biphenyl
    • DTXSID5074216
    • NS00077061
    • 5-AMINO-1-CYCLOPROPYL-6,7-DIFLUORO-1,4-DIHYDRO-8-METHYL-4-OXO-3-QUINOLINECARBOCYLICACID
    • DTXCID7047562
    • UNII-K42VE4HVAP
    • Inchi: 1S/C12H5Cl5/c13-6-2-1-3-7(14)10(6)11-8(15)4-5-9(16)12(11)17/h1-5H
    • InChI Key: QQFGAXUIQVKBKU-UHFFFAOYSA-N
    • SMILES: ClC1C(=CC=C(C=1C1C(=CC=CC=1Cl)Cl)Cl)Cl

Computed Properties

  • Exact Mass: 323.88300
  • Monoisotopic Mass: 323.883
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 249
  • 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: 6.1
  • Topological Polar Surface Area: 0A^2

Experimental Properties

  • Density: 1.5220 (rough estimate)
  • Melting Point: 95.86°C (estimate)
  • Boiling Point: 412.3°C (rough estimate)
  • Flash Point: 158.2°C
  • Refractive Index: 1.6200 (rough estimate)
  • PSA: 0.00000
  • LogP: 6.62060

2,2',3,6,6'-Pentachlorobiphenyl Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
P274430-1mg
2,2',3,6,6'-Pentachlorobiphenyl
73575-54-9
1mg
$190.00 2023-05-17
TRC
P274430-10mg
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$1499.00 2023-05-17
SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd.
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¥408.0 2021-09-08
SHANG HAI YI EN HUA XUE JI SHU Co., Ltd.
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¥402 2024-05-21

2,2',3,6,6'-Pentachlorobiphenyl Production Method

Additional information on 2,2',3,6,6'-Pentachlorobiphenyl

Comprehensive Overview of 2,2',3,6,6'-Pentachlorobiphenyl (CAS No. 73575-54-9): Properties, Applications, and Environmental Impact

2,2',3,6,6'-Pentachlorobiphenyl (CAS No. 73575-54-9) is a chlorinated organic compound belonging to the polychlorinated biphenyl (PCB) family. This compound has garnered significant attention due to its unique chemical properties and environmental implications. With growing concerns about persistent organic pollutants (POPs), researchers and industries are increasingly focusing on understanding the behavior and impact of such compounds.

The molecular formula of 2,2',3,6,6'-Pentachlorobiphenyl is C12H5Cl5, and it features five chlorine atoms attached to a biphenyl structure. This configuration contributes to its stability and resistance to degradation, making it a subject of interest in environmental studies. The compound's physicochemical properties, including its low water solubility and high lipophilicity, play a crucial role in its environmental distribution and bioaccumulation potential.

One of the most searched topics related to PCBs is their historical use in industrial applications. 2,2',3,6,6'-Pentachlorobiphenyl was once utilized in electrical equipment, such as transformers and capacitors, due to its excellent insulating properties. However, its production has been phased out in many countries under the Stockholm Convention on POPs, reflecting global efforts to mitigate environmental and health risks.

Recent advancements in analytical techniques, such as gas chromatography-mass spectrometry (GC-MS), have enabled more precise detection and quantification of 2,2',3,6,6'-Pentachlorobiphenyl in environmental samples. This has been particularly valuable for monitoring its presence in soil, water, and biota, addressing public concerns about environmental contamination and food safety.

Another hot topic in the context of PCBs is their potential health effects. While 2,2',3,6,6'-Pentachlorobiphenyl is not classified as acutely toxic, long-term exposure has been associated with various health issues. Researchers are actively investigating its endocrine-disrupting effects and potential links to chronic diseases, which aligns with the increasing public interest in chemical safety and risk assessment.

From an environmental perspective, the degradation pathways of 2,2',3,6,6'-Pentachlorobiphenyl are a subject of ongoing research. Microbial degradation and photochemical processes are among the natural mechanisms that can break down this compound, albeit slowly. Innovations in bioremediation and advanced oxidation processes are being explored to enhance the removal of such pollutants from contaminated sites.

The regulatory landscape surrounding 2,2',3,6,6'-Pentachlorobiphenyl continues to evolve, with agencies like the Environmental Protection Agency (EPA) and the European Chemicals Agency (ECHA) setting stringent guidelines for its management. This reflects the broader societal shift toward sustainable chemistry and the reduction of hazardous substances in the environment.

In the scientific community, 2,2',3,6,6'-Pentachlorobiphenyl serves as a model compound for studying the behavior of chlorinated aromatic hydrocarbons. Its structural features make it a valuable reference in environmental chemistry and toxicology research, contributing to a deeper understanding of similar pollutants.

Public awareness campaigns and educational initiatives are increasingly highlighting the importance of proper disposal and handling of PCB-containing materials. This aligns with the growing demand for green chemistry solutions and safer alternatives to traditional industrial chemicals.

In conclusion, 2,2',3,6,6'-Pentachlorobiphenyl (CAS No. 73575-54-9) remains a compound of significant scientific and environmental interest. Its study provides insights into the challenges posed by persistent organic pollutants and underscores the need for continued research and innovation in environmental protection and public health.

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