| CAS Number | 1803592-94-0 |
| Catalog Number | AG01AM70 |
| Chemical Name | 2-methyl-6-(propan-2-yl)pyridine-3-carboxylic acid hydrochloride |
| IUPAC Name | 2-methyl-6-propan-2-ylpyridine-3-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C10H13NO2.ClH/c1-6(2)9-5-4-8(10(12)13)7(3)11-9;/h4-6H,1-3H3,(H,12,13);1H |
| InChI Key | MGHPQAMFKOYZOY-UHFFFAOYSA-N |
| MDL Number | MFCD28968391 |
| Molecular Formula | C10H14ClNO2 |
| Molecular Weight | 215.6767 |
| SMILES | Cl.CC(C1=NC(C)=C(C(O)=O)C=C1)C |
| Synonyms | 1803592-94-0,
2-methyl-6-(propan-2-yl)pyridine-3-carboxylic acid hydrochloride,
Z2216303128,
|
| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.677g/mol |
| Monoisotopic Mass | 215.071g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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