| CAS Number | 2092286-66-1 |
| Catalog Number | AG01BVUE |
| Chemical Name | 2,2-dioxo-2lambda6-thiaspiro[3.3]heptane-6-carboxylic acid |
| IUPAC Name | 2,2-dioxo-2λ6-thiaspiro[3.3]heptane-6-carboxylic acid |
| InChI | InChI=1S/C7H10O4S/c8-6(9)5-1-7(2-5)3-12(10,11)4-7/h5H,1-4H2,(H,8,9) |
| InChI Key | AUUBVSVUCMPSKW-UHFFFAOYSA-N |
| MDL Number | MFCD30635373 |
| Molecular Formula | C7H10O4S |
| Molecular Weight | 190.2169 |
| SMILES | OC(C1CC2(CS(=O)(=O)C2)C1)=O |
| Synonyms | 2,2-dioxo-2lambda6-thiaspiro[3.3]heptane-6-carboxylic acid,
2092286-66-1,
CS-W023145,
2-thiaspiro[3.3]heptane-6-carboxylic acid 2,2-dioxide,
|
| Complexity | 304 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.213g/mol |
| Monoisotopic Mass | 190.03g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 79.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number