| CAS Number | 732968-98-8 |
| Catalog Number | AG019Z5M(AGN-PC-0WO4XS) |
| Chemical Name | 4-(2-Amino-1,3-thiazol-4-yl)butanoic acid |
| IUPAC Name | 4-(2-amino-1,3-thiazol-4-yl)butanoic acid |
| InChI | InChI=1S/C7H10N2O2S/c8-7-9-5(4-12-7)2-1-3-6(10)11/h4H,1-3H2,(H2,8,9)(H,10,11) |
| InChI Key | SGSNLIDODGFYDF-UHFFFAOYSA-N |
| MDL Number | MFCD20547539 |
| Molecular Formula | C7H10N2O2S |
| Molecular Weight | 186.2315 |
| SMILES | NC1SC=C(CCCC(O)=O)N=1 |
| Synonyms | 4-(2-amino-1,3-thiazol-4-yl)butanoic acid,
732968-98-8,
SCHEMBL7380564,
ZINC75567780,
AKOS022961581,
MCULE-6370106240,
NE29681,
RP24637,
Z1416200905,
|
| Complexity | 166 |
| 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 | 4 |
| Topological Polar Surface Area | 104A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number