| CAS Number | 886499-87-2 |
| Catalog Number | AG00IFAQ |
| Chemical Name | 2,4-Dibromo-6-(trifluoromethoxy)aniline |
| IUPAC Name | 2,4-dibromo-6-(trifluoromethoxy)aniline |
| InChI | InChI=1S/C7H4Br2F3NO/c8-3-1-4(9)6(13)5(2-3)14-7(10,11)12/h1-2H,13H2 |
| InChI Key | KJEAYONMSVJIRV-UHFFFAOYSA-N |
| MDL Number | MFCD07369998 |
| Molecular Formula | C7H4Br2F3NO |
| Molecular Weight | 334.9160 |
| SMILES | C1(Br)=CC(Br)=CC(=C1N)OC(F)(F)F |
| Synonyms | 2,4-dibromo-6-(trifluoromethoxy)aniline,
886499-87-2,
AC1OGGC5,
CTK5I6468,
ZINC4245011,
MFCD07369998,
AKOS024388258,
MCULE-1831190162,
2,4-dibromo-6-(trifluoromethoxy)phenylamine,
CS-0080863,
ST51042245,
ZINC04245011,
CID7148373,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 334.859g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 334.918g/mol |
| Monoisotopic Mass | 332.861g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number