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| IUPAC Name: | 1-bromo-3-nitro-5-(trifluoromethyl)benzene |
| Description: | 3-Bromo-5-nitrobenzotrifluoride (CAS# 630125-49-4) is an efficient D-glucosamine-based copper catalyst for C-X couplings and its application in synthesis of nilotinib intermediate. 3-Bromo-5-nitrobenzotrifluoride is also an intermediate for Nilotinib (N465300). |
| Molecular Weight: | 270.00 |
| Molecular Formula: | C7H3BrF3NO2 |
| Canonical SMILES: | C1=C(C=C(C=C1[N+](=O)[O-])Br)C(F)(F)F |
| InChI: | InChI=1S/C7H3BrF3NO2/c8-5-1-4(7(9,10)11)2-6(3-5)12(13)14/h1-3H |
| InChI Key: | YHTVYRKVFAFVLP-UHFFFAOYSA-N |
| Boiling Point: | 223.7 °C at 760 mmHg |
| Density: | 1.788 g/cm3 |
| MDL: | MFCD03788719 |
| LogP: | 3.89930 |
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Halides
1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
1-(4-Bromo-2-ethylpyrazol-3-yl)-N-methylmethanamine hydrochloride
1-{4-[3-(Trifluoromethyl)-1H-pyrazol-1-yl]phenyl}methanamine hydrochloride
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