≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488183114 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488183114 |
| Kanonisches Lächeln | C(#N)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl |
| IUPAC Name | 2,3,4,5,6-pentachlorobenzonitrile |
| InChIKey | INICGXSKJYKEIV-UHFFFAOYSA-N |
| INCHI | 1S/C7Cl5N/c8-3-2(1-13)4(9)6(11)7(12)5(3)10 |
| Isomere SMILES | C(#N)C1=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl |
| PubChem CID | 30363 |
| Molekulargewicht | 275.33 |
| Reaxy-Rn | 1879464 |
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 |
| Klasse | Benzene and substituted derivatives |
| Subclass | Benzonitriles |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzonitriles |
| Alternative Parents | Chlorobenzenes Aryl chlorides Nitriles Organopnictogen compounds Organochlorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzonitrile - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound |
| Beschreibung | This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Datum | Artikel |
|---|---|---|---|
 C2310325 | Certificate of Analysis | Jan 05, 2026 | P404933 |
| C2310306 | Certificate of Analysis | Jan 05, 2026 | P404933 |
| C2309673 | Certificate of Analysis | Jan 05, 2026 | P404933 |
| C2309672 | Certificate of Analysis | Jan 05, 2026 | P404933 |
| C2309671 | Certificate of Analysis | Jan 05, 2026 | P404933 |
| C2309666 | Certificate of Analysis | Jan 05, 2026 | P404933 |
| Löslichkeit | Soluble in Chloroform |
|---|---|
| Schmelzpunkt (°C) | 218 °C |
| Molekulargewicht | 275.300 g/mol |
| XLogP3 | 3.800 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 0 |
| Exact Mass | 274.844 Da |
| Monoisotopic Mass | 272.847 Da |
| Topological Polar Surface Area | 23.800 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 220.000 |
| 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 |
| 1. Jianping Ye, Qing Zhou, Zhihong Yan, Kang Li. (2021) Preparation of multicolor luminescence Schiff-base compound based on solvent control and its application in the detection of pentachloronitrobenzene. ANALYTICA CHIMICA ACTA, [PMID:34482876] [10.1016/j.aca.2021.338794] |
