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| IUPAC Name: | 2-amino-3,4-dimethylbenzoic acid |
| Description: | 2-Amino-3,4-dimethylbenzoic Acid (CAS# 50419-58-4) is an intermediate used in the synthesis of vadimezan, a tumor-vascular disrupting agent that attacks blood supply of cancerous tumor cells and causes tumor regression. |
| Molecular Weight: | 165.19 |
| Molecular Formula: | C9H11NO2 |
| Canonical SMILES: | CC1=C(C(=C(C=C1)C(=O)O)N)C |
| InChI: | InChI=1S/C9H11NO2/c1-5-3-4-7(9(11)12)8(10)6(5)2/h3-4H,10H2,1-2H3,(H,11,12) |
| InChI Key: | MUOBMUYSNYMSDM-UHFFFAOYSA-N |
| Boiling Point: | 341.7 °C at 760 mmHg |
| Density: | 1.207 g/cm3 |
| MDL: | MFCD00130041 |
| LogP: | 2.16500 |
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