| CAS Number | 1785360-85-1 |
| Catalog Number | AG01B25N |
| Chemical Name | 2-(hydroxymethyl)-1lambda6-thiolane-1,1-dione |
| IUPAC Name | (1,1-dioxothiolan-2-yl)methanol |
| InChI | InChI=1S/C5H10O3S/c6-4-5-2-1-3-9(5,7)8/h5-6H,1-4H2 |
| InChI Key | LMRSAJPNKCWDQI-UHFFFAOYSA-N |
| MDL Number | MFCD28550769 |
| Molecular Formula | C5H10O3S |
| Molecular Weight | 150.1961 |
| SMILES | OCC1S(=O)(=O)CCC1 |
| Synonyms | 2-(hydroxymethyl)-1lambda6-thiolane-1,1-dione,
1785360-85-1,
AKOS024195746,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 150.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 150.192g/mol |
| Monoisotopic Mass | 150.035g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 62.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number