| CAS Number | 1909305-67-4 |
| Catalog Number | AG01C2H1 |
| Chemical Name | 3-(dimethylamino)pyridine-2-carboxylic acid dihydrochloride |
| IUPAC Name | 3-(dimethylamino)pyridine-2-carboxylic acid;dihydrochloride |
| InChI | InChI=1S/C8H10N2O2.2ClH/c1-10(2)6-4-3-5-9-7(6)8(11)12;;/h3-5H,1-2H3,(H,11,12);2*1H |
| InChI Key | YCSKPNXJHAIRHN-UHFFFAOYSA-N |
| MDL Number | MFCD29054990 |
| Molecular Formula | C8H12Cl2N2O2 |
| Molecular Weight | 239.0991 |
| SMILES | Cl.Cl.CN(C1=C(C(O)=O)N=CC=C1)C |
| Synonyms | 3-(dimethylamino)pyridine-2-carboxylic acid dihydrochloride,
1909305-67-4,
Z2293610481,
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.096g/mol |
| Monoisotopic Mass | 238.028g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 53.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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