| CAS Number | 532987-19-2 |
| Catalog Number | AG01B5SM(AGN-PC-0SEV4A) |
| Chemical Name | (2R)-2-amino-2-(3-methoxyphenyl)ethan-1-ol hydrochloride |
| IUPAC Name | (2R)-2-amino-2-(3-methoxyphenyl)ethanol;hydrochloride |
| InChI | InChI=1S/C9H13NO2.ClH/c1-12-8-4-2-3-7(5-8)9(10)6-11;/h2-5,9,11H,6,10H2,1H3;1H/t9-;/m0./s1 |
| InChI Key | CHLMFPQGTHFLAT-FVGYRXGTSA-N |
| MDL Number | MFCD12758138 |
| Molecular Formula | C9H14ClNO2 |
| Molecular Weight | 203.6660 |
| SMILES | OC[C@H](N)C1=CC=CC(OC)=C1.[H]Cl |
| Synonyms | (2R)-2-amino-2-(3-methoxyphenyl)ethan-1-ol hydrochloride,
532987-19-2,
(r)-2-amino-2-(3-methoxyphenyl)ethanol hcl,
|
| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.666g/mol |
| Monoisotopic Mass | 203.071g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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