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| IUPAC Name: | 1-isocyanato-2-(trifluoromethyl)benzene |
| Description: | 2-(Trifluoromethyl)phenyl isocyanate (CAS# 2285-12-3) is a chemical reagent used in organic synthesis. Effective apixaban derivatives are synthesized using 2-(Trifluoromethyl)phenyl Isocyanate in an effort to develop more effective anti-coagulant agents. |
| Molecular Weight: | 187.12 |
| Molecular Formula: | C8H4F3NO |
| Canonical SMILES: | C1=CC=C(C(=C1)C(F)(F)F)N=C=O |
| InChI: | InChI=1S/C8H4F3NO/c9-8(10,11)6-3-1-2-4-7(6)12-5-13/h1-4H |
| InChI Key: | GZWGTVZRRFPVAS-UHFFFAOYSA-N |
| Boiling Point: | 75 ℃ / 40 mmHg |
| Density: | 1.23 g/cm3 |
| Appearance: | Liquid |
| MDL: | MFCD00002008 |
| LogP: | 2.67270 |
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