| CAS Number | 1250781-53-3 |
| Catalog Number | AG01AN7V |
| Chemical Name | 4-ethyl-2,3-dihydro-1,3-thiazol-2-one |
| IUPAC Name | 4-ethyl-3H-1,3-thiazol-2-one |
| InChI | InChI=1S/C5H7NOS/c1-2-4-3-8-5(7)6-4/h3H,2H2,1H3,(H,6,7) |
| InChI Key | VOHHVGOLNMVKMP-UHFFFAOYSA-N |
| MDL Number | MFCD16167389 |
| Molecular Formula | C5H7NOS |
| Molecular Weight | 129.1802 |
| SMILES | CCC1NC(=O)SC=1 |
| Synonyms | 4-ethyl-2,3-dihydro-1,3-thiazol-2-one,
1250781-53-3,
4-ethylthiazol-2-ol,
SCHEMBL10473796,
SCHEMBL16924352,
ZINC50182069,
AKOS011314986,
Z916925862,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 129.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 129.177g/mol |
| Monoisotopic Mass | 129.025g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number