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| IUPAC Name: | 2-amino-4,5-bis(2-methoxyethoxy)benzonitrile |
| Description: | A metabolite of Erlotinib. Erlotinib is a tyrosine kinase inhibitor which acts on the epidermal growth factor receptor (EGFR), inhibiting EGFR-associated kinase activity. |
| Molecular Weight: | 266.29 |
| Molecular Formula: | C13H18N2O4 |
| Canonical SMILES: | COCCOC1=C(C=C(C(=C1)C#N)N)OCCOC |
| InChI: | InChI=1S/C13H18N2O4/c1-16-3-5-18-12-7-10(9-14)11(15)8-13(12)19-6-4-17-2/h7-8H,3-6,15H2,1-2H3 |
| InChI Key: | XCXKYIJVCWFCLF-UHFFFAOYSA-N |
| Purity: | > 95 % |
| Solubility: | Keep in dark place, Inert atmosphere, Room temperature |
| Appearance: | White solid |
| Storage: | Keep in dark place, Inert atmosphere, Room temperature |
| LogP: | 1.77208 |
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[(2,3-Difluorophenyl)methyl][(1,3-dimethylpyrazol-4-yl)methyl]amine
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