3-[(4-methylphenyl)sulfanyl]-2H-chromen-2-one
3-(4-methylphenyl)sulfanylchromen-2-one
Also Known As: 3-[(4-methylphenyl)sulfanyl]-2H-chromen-2-one|3-(4-methylphenyl)sulfanylchromen-2-one|3-(4-methylphenylthio)chromen-2-one|NCGC00327690-01|3-(p-Tolylthio)-2H-1-benzopyran-2-one|AB01323175-02|AG-670/42027787
CAS: 78440-59-2
| Molecular Formula | C16H12O2S |
|---|---|
| Molecular Weight | 268.0558 g/mol |
| LogP | 4.25262 |
| Topological Polar Surface Area | 30.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.0558 |
| Monoisotopic Mass | 268.0558 |
| Heavy Atoms | 19 |
| Complexity | 772.60596 |
Chemical Identifiers
| CAS Number | 78440-59-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC2=CC3=CC=CC=C3OC2=O |
Product Overview
3-[(4-methylphenyl)sulfanyl]-2H-chromen-2-one (CAS 78440-59-2), with molecular formula C16H12O2S and molecular weight 268.0558 g/mol. IUPAC: 3-(4-methylphenyl)sulfanylchromen-2-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.
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