| CAS Number | 1208989-29-0 |
| Catalog Number | AG0093ZG(AGN-PC-0WAHKP) |
| Chemical Name | (R)-1-(4-(Trifluoromethoxy)phenyl)ethanamine hydrochloride |
| IUPAC Name | (1R)-1-[4-(trifluoromethoxy)phenyl]ethanamine;hydrochloride |
| InChI | InChI=1S/C9H10F3NO.ClH/c1-6(13)7-2-4-8(5-3-7)14-9(10,11)12;/h2-6H,13H2,1H3;1H/t6-;/m1./s1 |
| InChI Key | CRAQSXJYHZMDFP-FYZOBXCZSA-N |
| MDL Number | MFCD12757221 |
| Molecular Formula | C9H11ClF3NO |
| Molecular Weight | 241.6379 |
| SMILES | C[C@@H](N)C1=CC=C(OC(F)(F)F)C=C1.[H]Cl |
| Synonyms | 1208989-29-0,
(R)-1-(4-(Trifluoromethoxy)phenyl)ethanamine hydrochloride,
(R)-1-(4-(Trifluoromethoxy)phenyl)ethanamine HCl,
(1R)-1-[4-(trifluoromethoxy)phenyl]ethan-1-amine hydrochloride,
SCHEMBL20302874,
KS-00000SMV,
KS-000026FD,
MFCD12757221,
AKOS025117405,
GS-7305,
NE27798,
CS-0084816,
ST24035154,
(R)-1-(4-(Trifluoromethoxy)phenyl)ethan-1-amine hydrochloride,
1-(4-trifluoromethoxy-phenyl)-ethylamine,
ACN-054899,
(S)-1-(4-(Trifluoromethoxy)phenyl)ethanamine hydrochloride,
1391540-47-8,
|
| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.638g/mol |
| Monoisotopic Mass | 241.048g/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
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Certificate of Analysis
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