| CAS Number | 1537863-73-2 |
| Catalog Number | AG01ALGC |
| Chemical Name | 5-Phenyl-1lambda6,2-thiazolidine-1,1-dione |
| IUPAC Name | 5-phenyl-1,2-thiazolidine 1,1-dioxide |
| InChI | InChI=1S/C9H11NO2S/c11-13(12)9(6-7-10-13)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2 |
| InChI Key | DXKMEVHNIYSRKM-UHFFFAOYSA-N |
| MDL Number | MFCD26938351 |
| Molecular Formula | C9H11NO2S |
| Molecular Weight | 197.2541 |
| SMILES | O=S1(NCCC1C2=CC=CC=C2)=O |
| Synonyms | 5-phenyl-1lambda6,2-thiazolidine-1,1-dione,
1537863-73-2,
SCHEMBL15431918,
5-Phenylisothiazolidine 1,1-dioxide,
AKOS033790565,
5-phenyl-1lambda,2-thiazolidine-1,1-dione,
Z2186882445,
|
| Complexity | 262 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.252g/mol |
| Monoisotopic Mass | 197.051g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
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