| CAS Number | 1379610-44-2 |
| Catalog Number | AG00IRLN(AGN-PC-0WC91B) |
| Chemical Name | Methyl 2-(2-amino-5-ethyl-1,3-thiazol-4-yl)acetate |
| IUPAC Name | methyl 2-(2-amino-5-ethyl-1,3-thiazol-4-yl)acetate |
| InChI | InChI=1S/C8H12N2O2S/c1-3-6-5(4-7(11)12-2)10-8(9)13-6/h3-4H2,1-2H3,(H2,9,10) |
| InChI Key | HGZPDSOTTSAERI-UHFFFAOYSA-N |
| MDL Number | MFCD22373664 |
| Molecular Formula | C8H12N2O2S |
| Molecular Weight | 200.2581 |
| SMILES | S1(C(=NC(=C1CC)CC(=O)OC)N) |
| Synonyms | methyl 2-(2-amino-5-ethyl-1,3-thiazol-4-yl)acetate,
1379610-44-2,
MFCD22373664,
ZINC72319822,
AKOS015991227,
AD-0159,
MCULE-1116076515,
KS-000021Z5,
Methyl (2-amino-5-ethyl-1,3-thiazol-4-yl)acetate,
28942-54-3,
|
| Complexity | 189 |
| 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 | 4 |
| Topological Polar Surface Area | 93.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number