ST50993154
6-(4-methoxyphenyl)-4-methylsulfanyl-2-oxopyran-3-carbonitrile
Also Known As: 3-Cyano-4-(methylthio)-6-(4-methoxyphenyl)-2H-pyran-2-one|6-(4-methoxyphenyl)-4-methylsulfanyl-2-oxopyran-3-carbonitrile|2H-Pyran-3-carbonitrile, 6-(4-methoxyphenyl)-4-(methylthio)-2-oxo-|6-(4-methoxyphenyl)-4-(methylsulfanyl)-2-oxo-2H-pyran-3-carbonitrile|6-(4-methoxyphenyl)-4-methylthio-2-oxopyran-3-carbonitrile|2-Oxo-4-(methylthio)-6-(4-methoxyphenyl)-2H-pyran-3-carbonitrile|6-(4-Methoxyphenyl)-2-oxo-4-(methylthio)-2H-pyran-3-carbonitrile|6-(4-Methoxy-phenyl)-4-methylsulfanyl-2-oxo-2H-pyran-3-carbonitrile
| Molecular Formula | C14H11NO3S |
|---|---|
| Molecular Weight | 273.04596 g/mol |
| LogP | 2.90898 |
| Topological Polar Surface Area | 63.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.04596 |
| Monoisotopic Mass | 273.04596 |
| Heavy Atoms | 19 |
| Complexity | 683.31775 |
Chemical Identifiers
| CAS Number | 61380-86-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC(=C(C(=O)O2)C#N)SC |
Product Overview
ST50993154 (CAS 61380-86-7), with molecular formula C14H11NO3S and molecular weight 273.04596 g/mol. IUPAC: 6-(4-methoxyphenyl)-4-methylsulfanyl-2-oxopyran-3-carbonitrile.