| CAS Number | 1803585-37-6 |
| Catalog Number | AG01ALSM |
| Chemical Name | Methyl 2-(2-amino-1,3-thiazol-4-yl)-2-methylpropanoate |
| IUPAC Name | methyl 2-(2-amino-1,3-thiazol-4-yl)-2-methylpropanoate |
| InChI | InChI=1S/C8H12N2O2S/c1-8(2,6(11)12-3)5-4-13-7(9)10-5/h4H,1-3H3,(H2,9,10) |
| InChI Key | VPDPRKSBSOSNEO-UHFFFAOYSA-N |
| MDL Number | MFCD24627955 |
| Molecular Formula | C8H12N2O2S |
| Molecular Weight | 200.2581 |
| SMILES | O=C(OC)C(C)(C)C1=CSC(N)=N1 |
| Synonyms | methyl 2-(2-amino-1,3-thiazol-4-yl)-2-methylpropanoate,
1803585-37-6,
AKOS033755123,
ZINC238366695,
Z2065913147,
|
| Complexity | 208 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.256g/mol |
| Monoisotopic Mass | 200.062g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 93.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
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