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| IUPAC Name: | methyl 3-amino-4-methylbenzoate |
| Description: | Methyl 3-amino-4-methylbenzoate (CAS# 18595-18-1) is used as a reagent in the synthesis of perfluoroalkylated indoles which are very useful in drug development. It was also used in the preparation of 4-(pyrimidin-2-ylamino) benzamide derivatives which are designed as inhibitors of hedgehog signalling pathway (target of cancer treatment). |
| Molecular Weight: | 165.19 |
| Molecular Formula: | C9H11NO2 |
| Canonical SMILES: | CC1=C(C=C(C=C1)C(=O)OC)N |
| InChI: | InChI=1S/C9H11NO2/c1-6-3-4-7(5-8(6)10)9(11)12-2/h3-5H,10H2,1-2H3 |
| InChI Key: | YEPWCJHMSVABPQ-UHFFFAOYSA-N |
| Boiling Point: | 296.3 °C at 760 mmHg |
| Density: | 1.132 g/cm3 |
| MDL: | MFCD00025206 |
| LogP: | 1.94500 |
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