| CAS Number | 1934419-21-2 |
| Catalog Number | AG01DZ7V |
| Chemical Name | 5-ethynyl-3-methoxy-1,2-thiazole |
| IUPAC Name | 5-ethynyl-3-methoxy-1,2-thiazole |
| InChI | InChI=1S/C6H5NOS/c1-3-5-4-6(8-2)7-9-5/h1,4H,2H3 |
| InChI Key | GWACQMHWGFZKHH-UHFFFAOYSA-N |
| MDL Number | MFCD30275013 |
| Molecular Formula | C6H5NOS |
| Molecular Weight | 139.1750 |
| SMILES | COC1=NSC(C#C)=C1 |
| Synonyms | 5-ethynyl-3-methoxy-1,2-thiazole,
1934419-21-2,
|
| Complexity | 139 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 139.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 139.172g/mol |
| Monoisotopic Mass | 139.009g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 50.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number