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| IUPAC Name: | 3-amino-4-methylbenzoic acid |
| Description: | 3-Amino-4-methylbenzoic Acid (CAS# 2458-12-0) is used as a starting material to synthesize cyclopropamitosene compounds, which have potential antitumour activity. 3-Amino-4-methylbenzoic acid also has some partial herbicidal activity. |
| Molecular Weight: | 151.16 |
| Molecular Formula: | C8H9NO2 |
| Canonical SMILES: | CC1=C(C=C(C=C1)C(=O)O)N |
| InChI: | InChI=1S/C8H9NO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4H,9H2,1H3,(H,10,11) |
| InChI Key: | XKFIFYROMAAUDL-UHFFFAOYSA-N |
| Boiling Point: | 363.0±30.0°C at 760 mmHg |
| Melting Point: | 164-168°C |
| Purity: | ≥95% |
| Density: | 1.3±0.1 g/cm3 |
| Solubility: | Soluble in DMSO (Slightly), Methanol (Slightly) |
| Appearance: | Off-white to Pale Brown Solid |
| Storage: | Store at 2-8°C under inert atmosphere |
| MDL: | MFCD00007742 |
| LogP: | 1.85660 |
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2-(6-Ethyl-3-methyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid
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