| CAS Number | 1273879-49-4 |
| Catalog Number | AG01DV63 |
| Chemical Name | (3-chlorophenyl)[4-(trifluoromethyl)phenyl]methanamine |
| IUPAC Name | (3-chlorophenyl)-[4-(trifluoromethyl)phenyl]methanamine |
| InChI | InChI=1S/C14H11ClF3N/c15-12-3-1-2-10(8-12)13(19)9-4-6-11(7-5-9)14(16,17)18/h1-8,13H,19H2 |
| InChI Key | YESSYGIEIYUOIL-UHFFFAOYSA-N |
| MDL Number | MFCD17390168 |
| Molecular Formula | C14H11ClF3N |
| Molecular Weight | 285.692 |
| SMILES | NC(C1=CC(Cl)=CC=C1)C1=CC=C(C(F)(F)F)C=C1 |
| Synonyms | AKOS006127887,
(3-chlorophenyl)(4-(trifluoromethyl)phenyl)methanamine,
1273879-49-4,
|
| Complexity | 287 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 285.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 285.694g/mol |
| Monoisotopic Mass | 285.053g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
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