| CAS Number | 62822-68-8 |
| Catalog Number | AG01EIQ3(AGN-PC-0JDEEI) |
| Chemical Name | 5-methyl-1,3,2lambda6-dioxathiane-2,2-dione |
| IUPAC Name | 5-methyl-1,3,2-dioxathiane 2,2-dioxide |
| InChI | InChI=1S/C4H8O4S/c1-4-2-7-9(5,6)8-3-4/h4H,2-3H2,1H3 |
| InChI Key | JAABAXUXIQYUFF-UHFFFAOYSA-N |
| MDL Number | MFCD31667462 |
| Molecular Formula | C4H8O4S |
| Molecular Weight | 152.1689 |
| SMILES | CC1COS(=O)(=O)OC1 |
| Synonyms | 62822-68-8,
SCHEMBL18296581,
CTK1I8963,
DTXSID70796549,
1,3,2-Dioxathiane, 5-methyl-, 2,2-dioxide,
5-methyl-1,3,2lambda6-dioxathiane-2,2-dione,
5-Methyl-1,3,2lambda~6~-dioxathiane-2,2-dione,
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| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.014g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.164g/mol |
| Monoisotopic Mass | 152.014g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 61A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number