| CAS Number | 1391733-66-6 |
| Catalog Number | AG00HVG6(AGN-PC-0WG3UQ) |
| Chemical Name | 4,6-Dimethylpicolinic acid hydrochloride |
| IUPAC Name | 4,6-dimethylpyridine-2-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C8H9NO2.ClH/c1-5-3-6(2)9-7(4-5)8(10)11;/h3-4H,1-2H3,(H,10,11);1H |
| InChI Key | KSQQSMFNZGTLHY-UHFFFAOYSA-N |
| MDL Number | MFCD23378465 |
| Molecular Formula | C8H10ClNO2 |
| Molecular Weight | 187.6235 |
| SMILES | Cl.CC1=CC(C(O)=O)=NC(C)=C1 |
| Synonyms | 1391733-66-6,
4,6-DIMETHYLPICOLINIC ACID HYDROCHLORIDE,
4,6-Dimethylpicolinic acid HCl,
4,6-dimethylpyridine-2-carboxylic acid hydrochloride,
MFCD23378465,
AKOS027255317,
AM806131,
AS-39817,
CS-0038256,
Z2004548076,
4,6-dimethylpyridine-2-carboxylic acid;hydrochloride,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.623g/mol |
| Monoisotopic Mass | 187.04g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 50.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number