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| IUPAC Name: | (E)-3-[3-(difluoromethyl)phenyl]prop-2-enoic acid |
| Description: | 3-(Difluoromethyl)cinnamic Acid is derived from 3-Bromobenzaldehyde (B680290), which is a substituted benzaldehyde shown to have antibacterial activity against Mycobacterium tuberculosis. It is also a versatile building block, used in the synthesis of more complex pharmaceutical compounds. |
| Molecular Weight: | 198.17 |
| Molecular Formula: | C10H8F2O2 |
| Canonical SMILES: | C1=CC(=CC(=C1)C(F)F)C=CC(=O)O |
| InChI: | InChI=1S/C10H8F2O2/c11-10(12)8-3-1-2-7(6-8)4-5-9(13)14/h1-6,10H,(H,13,14)/b5-4+ |
| InChI Key: | UIVSQGLKEOLALV-SNAWJCMRSA-N |
| References: | Marcelle de Lima, F. et al. Lett. Dru. Des. Disc., 7, 754 (2010). |
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