≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads 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.
Information
AG 1406 is a potent and selective receptor tyrosine kinase VEGF receptor 2 inhibitor.
| Canonical Smiles | CC(C)C1=CC(=CC(=C1O)C(C)C)C=C(C#N)C#N |
|---|---|
| IUPAC Name | 2-[[4-hydroxy-3,5-di(propan-2-yl)phenyl]methylidene]propanedinitrile |
| InChIKey | JSDJFOADLLJFQX-UHFFFAOYSA-N |
| INCHI | 1S/C16H18N2O/c1-10(2)14-6-12(5-13(8-17)9-18)7-15(11(3)4)16(14)19/h5-7,10-11,19H,1-4H3 |
| Isomeric SMILES | CC(C)C1=CC(=CC(=C1O)C(C)C)C=C(C#N)C#N |
| Molecular Weight | 254.33 |
| Reaxy-Rn | 2855431 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2855431&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 | Cumenes |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Cumenes |
| Alternative Parents | Phenylpropanes Phenols Nitriles Organooxygen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Phenylpropane - Cumene - Phenol - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Cyanide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as cumenes. These are aromatic compounds containing a prop-2-ylbenzene moiety. |
| 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 |
|---|---|---|---|
 A2420020 | Certificate of Analysis | Dec 23, 2023 | A412268 |
| A2420021 | Certificate of Analysis | Dec 23, 2023 | A412268 |
| A2420022 | Certificate of Analysis | Dec 23, 2023 | A412268 |
| A2420023 | Certificate of Analysis | Dec 23, 2023 | A412268 |
| A2420024 | Certificate of Analysis | Dec 23, 2023 | A412268 |
| A2420025 | Certificate of Analysis | Dec 23, 2023 | A412268 |
| A2420026 | Certificate of Analysis | Dec 23, 2023 | A412268 |
| Molecular Weight | 254.330 g/mol |
|---|---|
| XLogP3 | 3.900 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 254.142 Da |
| Monoisotopic Mass | 254.142 Da |
| Topological Polar Surface Area | 67.800 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 396.000 |
| 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 |
