| CAS Number | 2177257-68-8 |
| Catalog Number | AG01DU70 |
| Chemical Name | (S)-1-(2-Methoxypyridin-4-yl)ethanamine dihydrochloride |
| IUPAC Name | (1S)-1-(2-methoxypyridin-4-yl)ethanamine;dihydrochloride |
| InChI | InChI=1S/C8H12N2O.2ClH/c1-6(9)7-3-4-10-8(5-7)11-2;;/h3-6H,9H2,1-2H3;2*1H/t6-;;/m0../s1 |
| InChI Key | IHKGPAMFFJTIDG-ILKKLZGPSA-N |
| MDL Number | MFCD31568153 |
| Molecular Formula | C8H14Cl2N2O |
| Molecular Weight | 225.1156 |
| SMILES | C[C@@H](C1=CC(OC)=NC=C1)N.[H]Cl.[H]Cl |
| Synonyms | (s)-1-(2-methoxypyridin-4-yl)ethanamine 2hcl,
AS-37614,
(S)-1-(2-METHOXYPYRIDIN-4-YL)ETHANAMINE DIHYDROCHLORIDE,
2177257-68-8,
|
| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.113g/mol |
| Monoisotopic Mass | 224.048g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 48.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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