≥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.
Isoxadifen-ethyl is a chemical used to protect cereal crops from sulfonyl urea herbicides in postemergence application and was shown to induce the cellular xenobiotic detoxification machinery in Arabidopsis thaliana when applied to leaves in a way mimicking field application.
| Pubchem Sid | 488195801 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488195801 |
| Canonical Smiles | CCOC(=O)C1=NOC(C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
| IUPAC Name | ethyl 5,5-diphenyl-4H-1,2-oxazole-3-carboxylate |
| InChIKey | MWKVXOJATACCCH-UHFFFAOYSA-N |
| INCHI | 1S/C18H17NO3/c1-2-21-17(20)16-13-18(22-19-16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3 |
| Isomeric SMILES | CCOC(=O)C1=NOC(C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
| UN Number | 3077 |
| Packing Group | III |
| Molecular Weight | 295.33 |
| Reaxy-Rn | 8913194 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8913194&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 | Diphenylmethanes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Diphenylmethanes |
| Alternative Parents | Isoxazolines Oxime ethers Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Diphenylmethane - Isoxazoline - Carboxylic acid ester - Oxime ether - Oxacycle - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups. |
| 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 |
|---|---|---|---|
 H2229687 | Certificate of Analysis | Jun 10, 2025 | I331164 |
| H2229688 | Certificate of Analysis | Jun 10, 2025 | I331164 |
| H2229689 | Certificate of Analysis | Jun 10, 2025 | I331164 |
| H2229690 | Certificate of Analysis | Jun 10, 2025 | I331164 |
| I2424505 | Certificate of Analysis | Sep 07, 2024 | I331164 |
| I2424506 | Certificate of Analysis | Sep 07, 2024 | I331164 |
| I2424507 | Certificate of Analysis | Sep 07, 2024 | I331164 |
| I2424508 | Certificate of Analysis | Sep 07, 2024 | I331164 |
| Melt Point(°C) | 87 °C |
|---|---|
| Molecular Weight | 295.300 g/mol |
| XLogP3 | 3.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 295.121 Da |
| Monoisotopic Mass | 295.121 Da |
| Topological Polar Surface Area | 47.900 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 402.000 |
| 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 |
