| CAS Number | 1784143-03-8 |
| Catalog Number | AG01B1TW |
| Chemical Name | 3-(Hydroxymethyl)thietane 1,1-dioxide |
| IUPAC Name | (1,1-dioxothietan-3-yl)methanol |
| InChI | InChI=1S/C4H8O3S/c5-1-4-2-8(6,7)3-4/h4-5H,1-3H2 |
| InChI Key | DWXBDUJNOXSPKX-UHFFFAOYSA-N |
| MDL Number | MFCD28652813 |
| Molecular Formula | C4H8O3S |
| Molecular Weight | 136.1695 |
| SMILES | OCC(C1)CS1(=O)=O |
| Synonyms | 1784143-03-8,
3-(Hydroxymethyl)thietane 1,1-dioxide,
ZINC216303225,
3-(hydroxymethyl)-1lambda6-thietane-1,1-dione,
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 136.019g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 136.165g/mol |
| Monoisotopic Mass | 136.019g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 62.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.1 |
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