| CAS Number | 31842-24-7 |
| Catalog Number | AG01B2OZ |
| Chemical Name | 4-[(dimethylamino)methyl]quinolin-3-ol dihydrochloride |
| IUPAC Name | 4-[(dimethylamino)methyl]quinolin-3-ol;dihydrochloride |
| InChI | InChI=1S/C12H14N2O.2ClH/c1-14(2)8-10-9-5-3-4-6-11(9)13-7-12(10)15;;/h3-7,15H,8H2,1-2H3;2*1H |
| InChI Key | YBXCEGKOPFZNBL-UHFFFAOYSA-N |
| MDL Number | MFCD29991700 |
| Molecular Formula | C12H16Cl2N2O |
| Molecular Weight | 275.1742 |
| SMILES | Cl.Cl.CN(CC1=C2C(C=CC=C2)=NC=C1O)C |
| Synonyms | 4-[(dimethylamino)methyl]quinolin-3-ol dihydrochloride,
31842-24-7,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 274.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 275.173g/mol |
| Monoisotopic Mass | 274.064g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 36.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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