| CAS Number | 1384429-77-9 |
| Catalog Number | AG019YMI |
| Chemical Name | 5-fluoro-2-(2,2,2-trifluoroethoxy)aniline hydrochloride |
| IUPAC Name | 5-fluoro-2-(2,2,2-trifluoroethoxy)aniline;hydrochloride |
| InChI | InChI=1S/C8H7F4NO.ClH/c9-5-1-2-7(6(13)3-5)14-4-8(10,11)12;/h1-3H,4,13H2;1H |
| InChI Key | ULYXHGWMPODWIN-UHFFFAOYSA-N |
| MDL Number | MFCD22196452 |
| Molecular Formula | C8H8ClF4NO |
| Molecular Weight | 245.6018 |
| SMILES | Cl.NC1=C(OCC(F)(F)F)C=CC(F)=C1 |
| Synonyms | 5-fluoro-2-(2,2,2-trifluoroethoxy)aniline hydrochloride,
1384429-77-9,
SCHEMBL16820005,
NE16822,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.023g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.602g/mol |
| Monoisotopic Mass | 245.023g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number