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| Sonrisas canónicas | C1=CC=C2C(=C1)NC3=C(S2)C=C(C=C3)C(F)(F)F |
|---|---|
| IUPAC Name | 3-(trifluoromethyl)-10H-phenothiazine |
| InChIKey | PRMGVNCDUJBHQW-UHFFFAOYSA-N |
| INCHI | 1S/C13H8F3NS/c14-13(15,16)8-5-6-10-12(7-8)18-11-4-2-1-3-9(11)17-10/h1-7,17H |
| Peso molecular | 267.27 |
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Clase | Benzothiazines |
| Subclass | Phenothiazines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenothiazines |
| Alternative Parents | Diarylthioethers Benzenoids 1,4-thiazines Secondary amines Azacyclic compounds Organopnictogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Phenothiazine - Diarylthioether - Aryl thioether - Para-thiazine - Benzenoid - Secondary amine - Thioether - Azacycle - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Alkyl fluoride - Hydrocarbon derivative - Alkyl halide - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as phenothiazines. These are polycyclic aromatic compounds containing a phenothiazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a para-thiazine ring. |
| External Descriptors | Not available |
| Peso molecular | 267.270 g/mol |
|---|---|
| XLogP3 | 5.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 0 |
| Exact Mass | 267.033 Da |
| Monoisotopic Mass | 267.033 Da |
| Topological Polar Surface Area | 37.300 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 307.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |