| CAS Number | 1803770-86-6 |
| Catalog Number | AG01DYYX |
| Chemical Name | 2-amino-4-fluoro-5-(trifluoromethyl)phenol |
| IUPAC Name | 2-amino-4-fluoro-5-(trifluoromethyl)phenol |
| InChI | InChI=1S/C7H5F4NO/c8-4-2-5(12)6(13)1-3(4)7(9,10)11/h1-2,13H,12H2 |
| InChI Key | BDYUTXNJABHCLK-UHFFFAOYSA-N |
| MDL Number | MFCD28796345 |
| Molecular Formula | C7H5F4NO |
| Molecular Weight | 195.1143 |
| SMILES | NC1=C(O)C=C(C(F)(F)F)C(F)=C1 |
| Synonyms | HE-CHEMICAL 0410545,
AKOS034170880,
1803770-86-6,
|
| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.031g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.117g/mol |
| Monoisotopic Mass | 195.031g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number