| CAS Number | 1201824-14-7 |
| Catalog Number | AG01AAKZ |
| Chemical Name | N-Methyl-3-(Trifluoromethoxy)Aniline Hydrochloride |
| IUPAC Name | N-methyl-3-(trifluoromethoxy)aniline;hydrochloride |
| InChI | InChI=1S/C8H8F3NO.ClH/c1-12-6-3-2-4-7(5-6)13-8(9,10)11;/h2-5,12H,1H3;1H |
| InChI Key | TVMPKHPYBZPMJR-UHFFFAOYSA-N |
| MDL Number | MFCD17167222 |
| Molecular Formula | C8H9ClF3NO |
| Molecular Weight | 227.6114 |
| SMILES | FC(F)(F)OC1=CC(NC)=CC=C1.[H]Cl |
| Synonyms | N-methyl-3-(trifluoromethoxy)aniline hydrochloride,
1201824-14-7,
AC1Q3BPY,
AKOS008110788,
MCULE-8387722681,
EN300-68908,
Z1263602459,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.032g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.611g/mol |
| Monoisotopic Mass | 227.032g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number