| CAS Number | 1797943-59-9 |
| Catalog Number | AG01BD0C |
| Chemical Name | 2-[4-(trifluoromethoxy)phenyl]propan-2-amine hydrochloride |
| IUPAC Name | 2-[4-(trifluoromethoxy)phenyl]propan-2-amine;hydrochloride |
| InChI | InChI=1S/C10H12F3NO.ClH/c1-9(2,14)7-3-5-8(6-4-7)15-10(11,12)13;/h3-6H,14H2,1-2H3;1H |
| InChI Key | HFTXCXIQRNDZAQ-UHFFFAOYSA-N |
| MDL Number | MFCD23379651 |
| Molecular Formula | C10H13ClF3NO |
| Molecular Weight | 255.6645 |
| SMILES | Cl.FC(OC1=CC=C(C=C1)C(C)(C)N)(F)F |
| Synonyms | 2-[4-(trifluoromethoxy)phenyl]propan-2-amine hydrochloride,
1797943-59-9,
AKOS026340184,
MCULE-6826710843,
NE18142,
Z1824511221,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.665g/mol |
| Monoisotopic Mass | 255.064g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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