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PCB No 52 - 100 ug/mL in Isooctane, high purity , CAS No.35693-99-3
Basic Description
Synonyms
2,2',5,5'-TETRACHLOROBIPHENYL | 35693-99-3 | 1,1'-Biphenyl, 2,2',5,5'-tetrachloro- | PCB 52 | 2,5,2',5'-Tetrachlorobiphenyl | TCBP | 2,2',5,5'-TCB | 2,3',5,6'-Tetrachlorobiphenyl | PCB No 52 | 2,2',5,5'-Tetrachloro-1,1'-biphenyl | CCRIS 6155 | PCB-52 | 1,4-dichloro-2-(2,5-dichlo
Specifications & Purity
100 ug/mL in Isooctane
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Chlorinated biphenyls
Direct Parent
Polychlorinated biphenyls
Alternative Parents
Dichlorobenzenes Aryl chlorides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Polychlorinated biphenyl - 1,4-dichlorobenzene - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as polychlorinated biphenyls. These are organic compounds containing at least two chlorine atoms attached to either benzene ring of the biphenyl moiety.
External Descriptors
dichlorobenzene - tetrachlorobiphenyl
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
IUPAC Name
1,4-dichloro-2-(2,5-dichlorophenyl)benzene
INCHI
InChI=1S/C12H6Cl4/c13-7-1-3-11(15)9(5-7)10-6-8(14)2-4-12(10)16/h1-6H
InChIKey
HCWZEPKLWVAEOV-UHFFFAOYSA-N
Smiles
C1=CC(=C(C=C1Cl)C2=C(C=CC(=C2)Cl)Cl)Cl
Isomeric SMILES
C1=CC(=C(C=C1Cl)C2=C(C=CC(=C2)Cl)Cl)Cl
Molecular Weight
291.99
Beilstein
2053828
Reaxy-Rn
2053828
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2053828&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Flash Point(°C)
-12°C
Molecular Weight
292.000 g/mol
XLogP3
6.100
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
1
Exact Mass
291.919 Da
Monoisotopic Mass
289.922 Da
Topological Polar Surface Area
0.000 Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
209.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
Citations of This Product
1.
Ting Pan, Xikun Chen, Chunmiao Kong, Dandan Gao, Wanjing Liu, Hongping Liao, Muhammad Junaid, Jun Wang.
(2023)
Single and combined toxicity of polystyrene nanoplastics and PCB-52 to the aquatic duckweed Spirodela polyrhiza. SCIENCE OF THE TOTAL ENVIRONMENT,
901
(166482).
2.
Shuo Wang, Pengfei Li, Yehong Han, Haiyan Liu, Hongyuan Yan.
(2022)
Selective enrichment and determination of polychlorinated biphenyls in milk by solid-phase microextraction using molecularly imprinted phenolic resin fiber coating. ANALYTICA CHIMICA ACTA,
1227
(340328).
3.
Wenchao Jia, Xiangying Jin, Yuhua Wu, Danping Xie, Wenhua Yin, Bo Zhao, Zhonghui Huang, Lijun Liu, Yanyan Yang, Tonghui Cao, Xidan Feng, Sheng Chang.
(2022)
Amplification of fluorescence polarization signal based on specific recognition of aptamers combined with quantum quenching effect for ultrasensitive and simple detection of PCB-77. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY,
278
(121341).
4.
Xiaowan Zhang, Dan Li, Mengyuan Li, Peige Qin, Shiping Zhu, Yanmei Gao, Mengyao Mu, Ning Zhang, Youmei Wang, Minghua Lu.
(2022)
Flower-like Co3O4/C3N5 composite as solid-phase microextraction coating for high-efficiency adsorption and preconcentration of polycyclic aromatic hydrocarbons and polychlorinated biphenyls in water. CHEMICAL ENGINEERING JOURNAL,
443
(136293).
5.
Xiaowan Zhang, Lizhen Han, Mengyuan Li, Peige Qin, Dan Li, Qian Zhou, Minghua Lu, Zongwei Cai.
(2021)
Nitrogen-rich carbon nitride as solid-phase microextraction fiber coating for high-efficient pretreatment of polychlorinated biphenyls from environmental samples. JOURNAL OF CHROMATOGRAPHY A,
1659
(462655).
6.
Cuizhong Zhang, Peican Chen, Liya Zhou, Jinyun Peng.
(2022)
Photoelectrochemical detection for 3,3′,4,4′-tetrachlorobiphenyl in fish based on synergistic effects by Schottky junction and sensitization. FOOD CHEMISTRY,
366
(130490).
7.
Lin Yuan, Qiang Fu, Maojuan Zhou, Yunqian Ma, Lihua Zang, Yingjian Qin, Dandan Ji, Fengshan Zhang.
(2021)
Highly sensitive and selective detection of PCB 77 using an aptamer-catalytic hairpin assembly in an aquatic environment. RSC Advances,
11
(10):
(5506-5511).
8.
Dandan Li,Jun Zhu,Man Wang,Wentao Bi,Xiaohua Huang,David Da Yong Chen.
(2017-03-03)
Extraction of trace polychlorinated biphenyls in environmental waters by well-dispersed velvet-like magnetic carbon nitride nanocomposites.. Journal of chromatography. A,
1491
(27-35).
9.
Guanglong Chen, Ting Pan, Dandan Gao, Hongping Liao, Jun Wang.
(2024)
Enhanced competitiveness of Spirodela polyrhiza in co-culture with Salvinia natans under combined exposure to polystyrene nanoplastics and polychlorinated biphenyls. SCIENCE OF THE TOTAL ENVIRONMENT,
955
(176870).
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9 Citations
L1910045