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| IUPAC Name: | 4-bromo-2-(trifluoromethyl)benzonitrile |
| Description: | 4-Bromo-2-(trifluoromethyl)benzonitrile (CAS# 191165-13-6) is an intermediate for the synthesis of 4-Bromo-2-(trifluoromethyl)phenylacetic Acid (B688526), which is a useful intermediate for organic synthesis and other chemical processes. |
| Molecular Weight: | 250.02 |
| Molecular Formula: | C8H3BrF3N |
| Canonical SMILES: | C1=CC(=C(C=C1Br)C(F)(F)F)C#N |
| InChI: | InChI=1S/C8H3BrF3N/c9-6-2-1-5(4-13)7(3-6)8(10,11)12/h1-3H |
| InChI Key: | XZZVLHLYHDELAI-UHFFFAOYSA-N |
| Boiling Point: | 239.7 °C at 760 mmHg |
| Density: | 1.71 g/cm3 |
| MDL: | MFCD06659466 |
| LogP: | 3.33958 |
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(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
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