3,4-dihydro-2H-1lambda6-benzothiopyran-1,1,4-trione
1,1-dioxo-2,3-dihydrothiochromen-4-one
Also Known As: Thiochromanone 1,1-dioxide|1,1-Dioxo-1lambda*6*-thiochroman-4-one|Thiochroman-4-one 1,1-dioxide|1,1-dioxo-2,3-dihydrothiochromen-4-one|Thiochroman-4-one,1-dioxide|Thiochroman-4-one, 1,1-dioxide|1,1-Dioxo-thiochroman-4-one|1,1-Dioxo-1lambda6-thiochroman-4-one|Fr12833|2H,3H-benzo[e]thiin-1,1,4-trione|1,1-Dioxo-1I>>6-thiochroman-4-one|3,4-dihydro-2H-1lambda6-benzothiopyran-1,1,4-trione|2,3-Dihydro-4H-thiochromen-4-one 1,1-dioxide|4H-1-Benzothiopyran-4-one, 2,3-dihydro-, 1,1-dioxide|3,4-dihydro-2H-1??-benzothiopyran-1,1,4-trione|2,3-dihydro-1-benzothiopyran-1,1,4-trione|3,4-dihydro-2H-1-benzothiopyran-1,1,4-trione|3,4-dihydro-2H-1-benzothiopyran-4-one 1,1-dioxide|AH-034/32845005|2,3-Dihydro-4H-thiochromen-4-one 1,1-dioxide #|3,4-dihydro-2H-1|E?-benzothiopyran-1,1,4-trione
| Molecular Formula | C9H8O3S |
|---|---|
| Molecular Weight | 196.01941 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 59.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.01941 |
| Monoisotopic Mass | 196.01941 |
| Heavy Atoms | 13 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 19446-96-9 |
|---|---|
| SMILES | C1CS(=O)(=O)C2=CC=CC=C2C1=O |
| InChIKey | NNJAUTBXMFSABH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-dihydro-2H-1lambda6-benzothiopyran-1,1,4-trione (CAS 19446-96-9), with molecular formula C9H8O3S and molecular weight 196.01941 g/mol. IUPAC: 1,1-dioxo-2,3-dihydrothiochromen-4-one.