4alpha,8alpha-(Methanothiomethano)naphthalene 10-oxide
12λ4-thiatricyclo[4.4.3.01,6]trideca-2,4,7,9-tetraene 12-oxide
Also Known As: 4alpha,8alpha-(Methanothiomethano)naphthalene 10-oxide|4a,8a-(Methanothiomethano)naphthalen-10-one|4.alpha.,8.alpha.-(Methanothiomethano)naphthalene-10-oxide
CAS: 64776-55-2
| Molecular Formula | C12H12OS |
|---|---|
| Molecular Weight | 204.06088 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.06088 |
| Monoisotopic Mass | 204.06088 |
| Heavy Atoms | 14 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 64776-55-2 |
|---|---|
| SMILES | C1C23C=CC=CC2(CS1=O)C=CC=C3 |
| InChIKey | XWFMHDCMXVMYIN-UHFFFAOYSA-N |
Product Overview
4alpha,8alpha-(Methanothiomethano)naphthalene 10-oxide (CAS 64776-55-2), with molecular formula C12H12OS and molecular weight 204.06088 g/mol. IUPAC: 12λ4-thiatricyclo[4.4.3.01,6]trideca-2,4,7,9-tetraene 12-oxide.
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.
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