| CAS Number | 1609399-76-9 |
| Catalog Number | AG00J22K(AGN-PC-0WCWT7) |
| Chemical Name | 2-[(dimethylamino)methyl]-1,3-thiazole-4-carboxylic acid hydrochloride |
| IUPAC Name | 2-[(dimethylamino)methyl]-1,3-thiazole-4-carboxylic acid;hydrochloride |
| InChI | InChI=1S/C7H10N2O2S.ClH/c1-9(2)3-6-8-5(4-12-6)7(10)11;/h4H,3H2,1-2H3,(H,10,11);1H |
| InChI Key | NXPZBXCUSKWSIB-UHFFFAOYSA-N |
| MDL Number | MFCD26959604 |
| Molecular Formula | C7H11ClN2O2S |
| Molecular Weight | 222.6924 |
| SMILES | C1(C(O)=O)=CSC(CN(C)C)=N1.Cl |
| Synonyms | 2-[(DIMETHYLAMINO)METHYL]-1,3-THIAZOLE-4-CARBOXYLIC ACID HYDROCHLORIDE,
1609399-76-9,
ZX-CM007727,
MFCD26959604,
|
| Complexity | 175 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 222.023g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 222.687g/mol |
| Monoisotopic Mass | 222.023g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 81.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number