| CAS Number | 1965309-73-2 |
| Catalog Number | AG01DKBD |
| Chemical Name | 2-(3-methoxypyridin-4-yl)ethanamine dihydrochloride |
| IUPAC Name | 2-(3-methoxypyridin-4-yl)ethanamine;dihydrochloride |
| InChI | InChI=1S/C8H12N2O.2ClH/c1-11-8-6-10-5-3-7(8)2-4-9;;/h3,5-6H,2,4,9H2,1H3;2*1H |
| InChI Key | AMXQLHDKIITSMP-UHFFFAOYSA-N |
| MDL Number | MFCD26954807 |
| Molecular Formula | C8H14Cl2N2O |
| Molecular Weight | 225.1156 |
| SMILES | Cl.Cl.COC=1C=NC=CC1CCN |
| Synonyms | 2-(3-Methoxy-pyridin-4-yl)-ethylamine dihydrochloride,
1965309-73-2,
2-(3-methoxypyridin-4-yl)ethanamine dihydrochloride,
NE64553,
CS-0062123,
2-(3-methoxypyridin-4-yl)ethan-1-amine dihydrochloride,
N/A,
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| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| 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 | 3 |
| 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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