| CAS Number | 1909316-63-7 |
| Catalog Number | AG01AUS6 |
| Chemical Name | 2-Methyl-1,3-oxazole-5-sulfonyl chloride |
| IUPAC Name | 2-methyl-1,3-oxazole-5-sulfonyl chloride |
| InChI | InChI=1S/C4H4ClNO3S/c1-3-6-2-4(9-3)10(5,7)8/h2H,1H3 |
| InChI Key | FEVFWCGDUCQXQJ-UHFFFAOYSA-N |
| MDL Number | MFCD29047224 |
| Molecular Formula | C4H4ClNO3S |
| Molecular Weight | 181.5975 |
| SMILES | O=S(C1=CN=C(C)O1)(Cl)=O |
| Synonyms | 2-Methyl-1,3-oxazole-5-sulfonyl chloride,
1909316-63-7,
ZINC299805241,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.96g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.59g/mol |
| Monoisotopic Mass | 180.96g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 68.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Lot Number