≥98% 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 | 504762022 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504762022 |
| Canonical Smiles | C1=C(C=C(C(=C1F)C#N)F)O |
| IUPAC Name | 2,6-difluoro-4-hydroxybenzonitrile |
| InChIKey | KEIYYIGMDPTAPL-UHFFFAOYSA-N |
| INCHI | 1S/C7H3F2NO/c8-6-1-4(11)2-7(9)5(6)3-10/h1-2,11H |
| Isomeric SMILES | C1=C(C=C(C(=C1F)C#N)F)O |
| UN Number | 3439 |
| Molecular Weight | 155.1 |
| Reaxy-Rn | 6967754 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6967754&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 | Benzonitriles |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzonitriles |
| Alternative Parents | M-fluorophenols Fluorobenzenes 1-hydroxy-2-unsubstituted benzenoids Aryl fluorides Nitriles Organopnictogen compounds Organooxygen compounds Organofluorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzonitrile - 3-halophenol - 3-fluorophenol - 1-hydroxy-2-unsubstituted benzenoid - Fluorobenzene - Phenol - Halobenzene - Aryl fluoride - Aryl halide - Carbonitrile - Nitrile - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound |
| Description | 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 | Date | Item |
|---|---|---|---|
 K1816157 | Certificate of Analysis | Jun 11, 2026 | D101742 |
| I1418170 | Certificate of Analysis | Apr 15, 2026 | D101742 |
| F2224361 | Certificate of Analysis | Apr 02, 2026 | D101742 |
| I2320448 | Certificate of Analysis | Aug 17, 2023 | D101742 |
| I2320449 | Certificate of Analysis | Aug 17, 2023 | D101742 |
| I2320450 | Certificate of Analysis | Aug 17, 2023 | D101742 |
| I2320490 | Certificate of Analysis | Aug 17, 2023 | D101742 |
| I2320491 | Certificate of Analysis | Aug 17, 2023 | D101742 |
| I2320492 | Certificate of Analysis | Aug 17, 2023 | D101742 |
| F2224362 | Certificate of Analysis | Jun 01, 2022 | D101742 |
| G1804116 | Certificate of Analysis | May 09, 2022 | D101742 |
| Solubility | Soluble in methanol |
|---|---|
| Melt Point(°C) | 127°C |
| Molecular Weight | 155.100 g/mol |
| XLogP3 | 1.500 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 155.018 Da |
| Monoisotopic Mass | 155.018 Da |
| Topological Polar Surface Area | 44.000 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 176.000 |
| 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 |
