4-{[(butan-2-yl)sulfanyl]methyl}-5-methylfuran-2-carboxylic acid
					Chemical Structure Depiction of
4-{[(butan-2-yl)sulfanyl]methyl}-5-methylfuran-2-carboxylic acid
			4-{[(butan-2-yl)sulfanyl]methyl}-5-methylfuran-2-carboxylic acid
Compound characteristics
| Compound ID: | 8005-9615 | 
| Compound Name: | 4-{[(butan-2-yl)sulfanyl]methyl}-5-methylfuran-2-carboxylic acid | 
| Molecular Weight: | 228.31 | 
| Molecular Formula: | C11 H16 O3 S | 
| Smiles: | CCC(C)SCc1cc(C(O)=O)oc1C | 
| Stereo: | RACEMIC MIXTURE | 
| logP: | 2.7318 | 
| logD: | -0.5585 | 
| logSw: | -2.5843 | 
| Hydrogen bond acceptors count: | 5 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 36.972 | 
| InChI Key: | BLQZTMZQZKDDTO-ZETCQYMHSA-N | 
 
				 
				