| CAS Number | 1485749-64-1 |
| Catalog Number | AG01E8GY |
| Chemical Name | 2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoic acid |
| IUPAC Name | 2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoic acid |
| InChI | InChI=1S/C7H10N2O2S/c1-4-3-12-7(8-4)9-5(2)6(10)11/h3,5H,1-2H3,(H,8,9)(H,10,11) |
| InChI Key | KBSQOUBWSOTEEC-UHFFFAOYSA-N |
| MDL Number | MFCD12176723 |
| Molecular Formula | C7H10N2O2S |
| Molecular Weight | 186.2315 |
| SMILES | CC(C(O)=O)NC1SC=C(C)N=1 |
| Synonyms | 2-[(4-methyl-1,3-thiazol-2-yl)amino]propanoic acid,
AKOS009503465,
MCULE-8012851672,
NE19443,
Z1404660497,
1485749-64-1,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.229g/mol |
| Monoisotopic Mass | 186.046g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 90.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
Lot Number