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| IUPAC Name: | 3-nitro-4-(trifluoromethyl)benzoic acid |
| Description: | 3-Nitro-4-(trifluoromethyl)benzoic Acid (CAS# 116965-16-3) is useful intermediate for the preparation of trifluoromethylated (benzoxazolyl)actinocins. |
| Molecular Weight: | 235.12 |
| Molecular Formula: | C8H4F3NO4 |
| Canonical SMILES: | C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])C(F)(F)F |
| InChI: | InChI=1S/C8H4F3NO4/c9-8(10,11)5-2-1-4(7(13)14)3-6(5)12(15)16/h1-3H,(H,13,14) |
| InChI Key: | NIWGMOJIGTUDFT-UHFFFAOYSA-N |
| Boiling Point: | 330 °C at 760 mmHg |
| Density: | 1.596 g/cm3 |
| MDL: | MFCD00274359 |
| LogP: | 2.83500 |
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(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
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