| CAS Number | 1073182-76-9 |
| Catalog Number | AG00HAZ1(AGN-PC-0CVR5Z) |
| Chemical Name | 3-amino-6-chloro-4-methylpyridine-2-carboxylic acid |
| IUPAC Name | 3-amino-6-chloro-4-methylpyridine-2-carboxylic acid |
| InChI | InChI=1S/C7H7ClN2O2/c1-3-2-4(8)10-6(5(3)9)7(11)12/h2H,9H2,1H3,(H,11,12) |
| InChI Key | UPAKKZSHZTWQKK-UHFFFAOYSA-N |
| MDL Number | MFCD18382760 |
| Molecular Formula | C7H7ClN2O2 |
| Molecular Weight | 186.5957 |
| SMILES | O=C(O)C1=NC(Cl)=CC(C)=C1N |
| Synonyms | 3-Amino-6-chloro-4-methylpicolinic acid,
1073182-76-9,
SCHEMBL536181,
UPAKKZSHZTWQKK-UHFFFAOYSA-N,
ZINC88189949,
FCH1190930,
AJ-128166,
AX8290613,
3-amino-6-chloro-4-methyl-pyridine-2-carboxylic acid,
3-amino-6-chloro-4-methylpyridine-2-carboxylic acid,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.595g/mol |
| Monoisotopic Mass | 186.02g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 76.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number