| CAS Number | 2171225-73-1 |
| Catalog Number | AG01DU50 |
| Chemical Name | [(1S)-1-(2-CHLOROPHENYL)ETHYL](METHYL)AMINE HYDROCHLORIDE |
| IUPAC Name | (1S)-1-(2-chlorophenyl)-N-methylethanamine;hydrochloride |
| InChI | InChI=1S/C9H12ClN.ClH/c1-7(11-2)8-5-3-4-6-9(8)10;/h3-7,11H,1-2H3;1H/t7-;/m0./s1 |
| InChI Key | BNEOSYMAHAISMO-FJXQXJEOSA-N |
| MDL Number | MFCD31629245 |
| Molecular Formula | C9H13Cl2N |
| Molecular Weight | 206.1122 |
| SMILES | Cl.ClC1=C(C=CC=C1)[C@H](C)NC |
| Synonyms | [(1S)-1-(2-CHLOROPHENYL)ETHYL](METHYL)AMINE HYDROCHLORIDE,
2171225-73-1,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.11g/mol |
| Monoisotopic Mass | 205.043g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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