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| IUPAC Name: | 3-(trifluoromethyl)benzaldehyde |
| Description: | 3-(Trifluoromethyl)benzaldehyde (CAS# 454-89-7) is used as a reagent in the synthesis of 2,3-di- and 2,2,3-trisubstituted-3-methoxycarbonyl-γ-butyrolactones as potent antitumor agents. Also used as a reagent in the synthesis of novel chalcone derivatives as hypoxia-inducible factor (HIF)-1 inhibitors. |
| Molecular Weight: | 174.12 |
| Molecular Formula: | C8H5F3O |
| Canonical SMILES: | C1=CC(=CC(=C1)C(F)(F)F)C=O |
| InChI: | InChI=1S/C8H5F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-5H |
| InChI Key: | NMTUHPSKJJYGML-UHFFFAOYSA-N |
| Boiling Point: | 83-86 °C (30 mmHg) |
| Purity: | 97 % |
| Density: | 1.301 g/cm3 |
| Appearance: | Clear colourless to very slightly orange liquid |
| Storage: | Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Do not expose to air. Store under an inert atmosphere. |
| MDL: | MFCD00003373 |
| LogP: | 2.51790 |
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(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
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