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Cited in 378 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | C1=CC=C(C(=C1)Cl)Cl |
|---|---|
| IUPAC Name | 1,2-dichlorobenzene |
| InChIKey | RFFLAFLAYFXFSW-UHFFFAOYSA-N |
| INCHI | 1S/C6H4Cl2/c7-5-3-1-2-4-6(5)8/h1-4H |
| Isomeric SMILES | C1=CC=C(C(=C1)Cl)Cl |
| UN Number | 1591 |
| Packing Group | III |
| Molecular Weight | 147.00 |
| Reaxy-Rn | 606078 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=606078&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Halobenzenes |
| Intermediate Tree Nodes | Chlorobenzenes |
| Direct Parent | Dichlorobenzenes |
| Alternative Parents | Aryl chlorides Organochlorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | 1,2-dichlorobenzene - Aryl halide - Aryl chloride - Hydrocarbon derivative - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it. |
| External Descriptors | a chloroaromatic compound |
| Sensitivity | Hygroscopic |
|---|---|
| Refractive Index | 1.55 |
| Flash Point(°C) | 66°C |
| Boil Point(°C) | 180.5°C |
| Molecular Weight | 147.000 g/mol |
| XLogP3 | 3.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 0 |
| Exact Mass | 145.969 Da |
| Monoisotopic Mass | 145.969 Da |
| Topological Polar Surface Area | 0.000 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 62.900 |
| 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 |
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| 60. Zhangchi Xiao, Xueyu Nie, Yong Li, Yulun Nie, Liqiang Lu, Xike Tian. (2023) Boric Acid Functional Fluorescent Covalent–Organic Framework for Sensitive and Selective Visualization of CH3Hg+. ACS Applied Materials & Interfaces, [PMID:36757912] [10.1021/acsami.2c23302] |
| 61. Benbing Shi, Xiao Pang, Bohui Lyu, Hong Wu, Jianliang Shen, Jingyuan Guan, Xiaoyao Wang, Chunyang Fan, Li Cao, Tianhao Zhu, Yan Kong, Yawei Liu, Zhongyi Jiang. (2023) Spacer-Engineered Ionic Channels in Covalent Organic Framework Membranes toward Ultrafast Proton Transport. ADVANCED MATERIALS, 35 (16): (2211004). [PMID:36683382] [10.1002/adma.202211004] |
| 62. Ziyang Wang, Xinyuan Zhang, Jianbo Wu, Lishan Liang, Xinyi Niu, Qin Chen, Ruiqing Li, Junhua Luo. (2023) Utilizing Angle-Dependent Photovoltage Effect in a CH3NH3PbCl3/Si Heterojunction toward High-Performance Polarized Light Detection in Ultraviolet Region. Advanced Optical Materials, 11 (6): (2202383). [PMID:] [10.1002/adom.202202383] |
| 63. Ting Li, Xi Zhao, Xueli Cao. (2023) Volatile Metabolome and Aroma Differences of Six Cultivars of Prunus mume Blossoms. Plants-Basel, 12 (2): (308). [PMID:36679020] [10.3390/plants12020308] |
| 64. Wei Wang, Minjuan Gong, Donghai Zhu, Mohammadtaghi Vakili, Zahra Gholami, Huanhuan Jiang, Shuangxi Zhou, Han Qu. (2023) Post-synthetic thiol modification of covalent organic frameworks for mercury(II) removal from water. Environmental Science and Ecotechnology, [PMID:36793397] [10.1016/j.ese.2023.100236] |
| 65. Zhiwei Mei, Haihan Li, Guanbo Wang, Yanqi Mao, Yuncun Xu, Jiaming Guo, Qingyu Li, Huaifeng Li, Wenqiong Li, Yanmei Tang, Xiaoguang Liang. (2023) Solvent-free and in situ synthesis of three-dimensional covalent organic frameworks thin films on Zn anodes for Zn–air batteries. APPLIED SURFACE SCIENCE, [PMID:] [10.1016/j.apsusc.2022.156324] |
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| 67. Rui Liu, Yiwen Nie, Junjie Chen, Chunhui Shen, Shanjun Gao. (2022) Anion exchange membranes based on poly (styrene-b-(ethylene-co-butylene)-b-styrene) grafted poly (2,6-dimethyl-1,4-phenylene oxide). JOURNAL OF APPLIED POLYMER SCIENCE, 140 (10): (e53579). [PMID:] [10.1002/app.53579] |
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