3-butyl-2-methyl-1,3-benzothiazol-3-ium--iodide (1/1)
Chemical Structure Depiction of
3-butyl-2-methyl-1,3-benzothiazol-3-ium--iodide (1/1)
3-butyl-2-methyl-1,3-benzothiazol-3-ium--iodide (1/1)
Compound characteristics
Compound ID: | 1493-0240 |
Compound Name: | 3-butyl-2-methyl-1,3-benzothiazol-3-ium--iodide (1/1) |
Molecular Weight: | 333.23 |
Molecular Formula: | C12 H16 N S |
Salt: | I- |
Smiles: | CCCC[n+]1c2ccccc2sc1C |
Stereo: | ACHIRAL |
logP: | 4.0993 |
logD: | 4.0993 |
logSw: | -3.9257 |
Polar surface area: | 1.748 |
InChI Key: | WUBADEYCUXCRMK-UHFFFAOYSA-N |