7-Thiabicyclo[4.2.0]octa-1,3,5-trien-8-one
7-thiabicyclo[4.2.0]octa-1,3,5-trien-8-one
Also Known As: benzothiet-2-one|2H-1-Thiabenzocyclobutene-2-one|7-Thiabicyclo[4.2.0]octa-1,3,5-trien-8-one|2,4-Cyclohexadien-1-one,6-carbonyl|7-Thiabicyclo(4.2.0)octa-1,3,5-trien-8-one|7-Thia-bicyclo[4.2.0]octa-1,3,5-trien-8-one|8-THIABICYCLO[4.2.0]OCTA-1,3,5-TRIEN-7-ONE
CAS: 21083-36-3
| Molecular Formula | C7H4OS |
|---|---|
| Molecular Weight | 135.99829 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 135.99829 |
| Monoisotopic Mass | 135.99829 |
| Heavy Atoms | 9 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 21083-36-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)S2 |
| InChIKey | CAEMCYVDPUUSQT-UHFFFAOYSA-N |
Product Overview
7-Thiabicyclo[4.2.0]octa-1,3,5-trien-8-one (CAS 21083-36-3), with molecular formula C7H4OS and molecular weight 135.99829 g/mol. IUPAC: 7-thiabicyclo[4.2.0]octa-1,3,5-trien-8-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
7-Thiabicyclo[4.2.0]octa-1,3,5-trien-8-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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