≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488188188 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488188188 |
| Sonrisas canónicas | C1=CC(=C(C=C1C#N)Cl)F |
| IUPAC Name | 3-chloro-4-fluorobenzonitrile |
| InChIKey | VAHXXQJJZKBZDX-UHFFFAOYSA-N |
| INCHI | 1S/C7H3ClFN/c8-6-3-5(4-10)1-2-7(6)9/h1-3H |
| Isómeros SMILES | C1=CC(=C(C=C1C#N)Cl)F |
| WGK Alemania | 3 |
| Peso molecular | 155.56 |
| Beilstein | 4740501 |
| Reaxy-Rn | 4740501 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4740501&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 |
| Clase | Benzene and substituted derivatives |
| Subclass | Benzonitriles |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzonitriles |
| Alternative Parents | Fluorobenzenes Chlorobenzenes Aryl fluorides Aryl chlorides Nitriles Organopnictogen compounds Organofluorides Organochlorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzonitrile - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Carbonitrile - Nitrile - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Aromatic homomonocyclic compound |
| Descripción | 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 | Fecha | Articulo |
|---|---|---|---|
 G1312038 | Certificate of Analysis | Feb 08, 2025 | C120881 |
| G2410149 | Certificate of Analysis | Apr 28, 2024 | C120881 |
| G2410150 | Certificate of Analysis | Apr 28, 2024 | C120881 |
| G2410151 | Certificate of Analysis | Apr 28, 2024 | C120881 |
| A2408805 | Certificate of Analysis | Nov 23, 2023 | C120881 |
| A2408806 | Certificate of Analysis | Nov 23, 2023 | C120881 |
| A2408807 | Certificate of Analysis | Nov 23, 2023 | C120881 |
| A2408808 | Certificate of Analysis | Nov 23, 2023 | C120881 |
| C2322023 | Certificate of Analysis | Mar 31, 2023 | C120881 |
| F1829067 | Certificate of Analysis | Apr 27, 2022 | C120881 |
| Solubilidad | Soluble in Methanol |
|---|---|
| Punto de ebullición (°C) | 135 °C/65 mmHg |
| Punto de fusión (°C) | 69-71°C |
| Peso molecular | 155.550 g/mol |
| XLogP3 | 2.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 154.994 Da |
| Monoisotopic Mass | 154.994 Da |
| Topological Polar Surface Area | 23.800 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 162.000 |
| 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 |
