≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships FedEx DG Service Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 4 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Application：
3-Chlorotoluene was used as catalyst in the synthesis of glycidyl methacrylate grafted multi-walled carbon nanotubes/polypropylene nanocomposites. It was used to study paramagnetic contributions from dioxygen to solute proton spin-lattice relaxation rate constants for a series of aromatic hydrocarbons and drug molecule fragments
| Pubchem Sid | 488180610 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488180610 |
| Canonical Smiles | CC1=CC(=CC=C1)Cl |
| IUPAC Name | 1-chloro-3-methylbenzene |
| InChIKey | OSOUNOBYRMOXQQ-UHFFFAOYSA-N |
| INCHI | 1S/C7H7Cl/c1-6-3-2-4-7(8)5-6/h2-5H,1H3 |
| Isomeric SMILES | CC1=CC(=CC=C1)Cl |
| WGK Germany | 2 |
| UN Number | 2238 |
| Packing Group | III |
| Molecular Weight | 126.59 |
| Beilstein | 5291 |
| Reaxy-Rn | 1903632 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1903632&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 | Not available |
| Direct Parent | Chlorobenzenes |
| Alternative Parents | Toluenes Aryl chlorides Organochlorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Toluene - 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 chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety. |
| External Descriptors | a chloroaromatic compound |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 J2217267 | Certificate of Analysis | Apr 02, 2026 | C104627 |
| J2217270 | Certificate of Analysis | Apr 02, 2026 | C104627 |
| K1412043 | Certificate of Analysis | Nov 06, 2025 | C104627 |
| E2325672 | Certificate of Analysis | Feb 07, 2025 | C104627 |
| E2325673 | Certificate of Analysis | Feb 07, 2025 | C104627 |
| E2325678 | Certificate of Analysis | Feb 07, 2025 | C104627 |
| E2325682 | Certificate of Analysis | Feb 07, 2025 | C104627 |
| E2325686 | Certificate of Analysis | Feb 07, 2025 | C104627 |
| E2325692 | Certificate of Analysis | Feb 07, 2025 | C104627 |
| J2217269 | Certificate of Analysis | Jul 18, 2024 | C104627 |
| D2428169 | Certificate of Analysis | Mar 22, 2024 | C104627 |
| G2131137 | Certificate of Analysis | May 09, 2023 | C104627 |
| G2131138 | Certificate of Analysis | May 09, 2023 | C104627 |
| L2418120 | Certificate of Analysis | Feb 20, 2023 | C104627 |
| I2214167 | Certificate of Analysis | Apr 25, 2021 | C104627 |
| I2214169 | Certificate of Analysis | Apr 25, 2021 | C104627 |
| Solubility | Insoluble in water, soluble in ethanol, benzene, chloroform, easily soluble in ether, etc. |
|---|---|
| Refractive Index | 1.5218 |
| Flash Point(°F) | 125.6 °F - closed cup |
| Flash Point(°C) | 52 °C - closed cup |
| Boil Point(°C) | 160-162 °C |
| Melt Point(°C) | -48°C |
| Molecular Weight | 126.580 g/mol |
| XLogP3 | 3.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 0 |
| Exact Mass | 126.024 Da |
| Monoisotopic Mass | 126.024 Da |
| Topological Polar Surface Area | 0.000 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 70.800 |
| 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 |
| 1. Xue Li, Yuan-Yuan Cui, Cheng-Xiong Yang. (2020) Covalent coupling fabrication of microporous organic network bonded capillary columns for gas chromatographic separation. TALANTA, [PMID:33379116] [10.1016/j.talanta.2020.121914] |
| 2. Yang Liu, Jian Li, Jiawei Liu, Changwei Tang, Quan Bai. (2024) Fabrication of hierarchically porous University of Oslo-66@silica shell-core stationary phase by phosphoric acid etching strategy for enhanced separation performance in liquid chromatography. MICROCHEMICAL JOURNAL, [PMID:] [10.1016/j.microc.2024.111110] |
| 3. Wen-Chao Deng, Hai-Long Qian, Cheng Yang, Shu-Ting Xu, Xiu-Ping Yan. (2023) General Two-Step Method for the Fabrication of Covalent-Organic Framework-Bound Open-Tubular Capillary Columns for High-Resolution Gas Chromatography Separation of Isomers. ACS Applied Materials & Interfaces, [PMID:37963803] [10.1021/acsami.3c13853] |
| 4. Jinhua Xu, Minghui Tang, Jinyu Zhang, Wenmin Zhang, Shiye Xie, Lan Zhang. (2025) Green and Controlled Synthesis of Copper-Based Tryptophan Flower-like Chiral Metal-Organic Framework for Enantioselective Recognition and Volatile Organic Compound Separation. JOURNAL OF CHROMATOGRAPHY A, [PMID:40339186] [10.1016/j.chroma.2025.466020] |
| 5. Hong-Mei Fu, Xi-Peng Zhang, Shi-Chao Qi, Ding-Hua Liu. (2025) Efficient liquid-phase adsorptive separation between p- and m-Chlorotoluene by a metal-organic framework Mn-dhbq. SEPARATION AND PURIFICATION TECHNOLOGY, [PMID:] [10.1016/j.seppur.2025.135978] |
