≥96% 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.
| Canonical Smiles | C1=CC(=C(C(=C1C#N)F)F)F |
|---|---|
| IUPAC Name | 2,3,4-trifluorobenzonitrile |
| InChIKey | KTPHYLJFAZNALV-UHFFFAOYSA-N |
| INCHI | 1S/C7H2F3N/c8-5-2-1-4(3-11)6(9)7(5)10/h1-2H |
| Isomeric SMILES | C1=CC(=C(C(=C1C#N)F)F)F |
| PubChem CID | 518936 |
| Molecular Weight | 157.1 |
| Reaxy-Rn | 5427682 |
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 | Fluorobenzenes Aryl fluorides Nitriles Organopnictogen compounds Organofluorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Benzonitrile - Halobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen 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 |
|---|---|---|---|
 F2624044 | Certificate of Analysis | Jun 27, 2026 | T419715 |
| F2205166 | Certificate of Analysis | Mar 13, 2026 | T419715 |
| F2205167 | Certificate of Analysis | Mar 13, 2026 | T419715 |
| F2205170 | Certificate of Analysis | Mar 13, 2026 | T419715 |
| F2205171 | Certificate of Analysis | Mar 13, 2026 | T419715 |
| F2205172 | Certificate of Analysis | Mar 13, 2026 | T419715 |
| L2406088 | Certificate of Analysis | Jun 08, 2022 | T419715 |
| Refractive Index | 1.473 |
|---|---|
| Flash Point(°F) | 154°F |
| Flash Point(°C) | 68°C(lit.) |
| Boil Point(°C) | 116-118℃/100mm |
| Molecular Weight | 157.090 g/mol |
| XLogP3 | 1.900 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 157.014 Da |
| Monoisotopic Mass | 157.014 Da |
| Topological Polar Surface Area | 23.800 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 185.000 |
| 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 |
