Stk326631
3-(3-methyl-1,3-benzothiazol-2-ylidene)pentane-2,4-dione
Also Known As: BAS 00015509|1H-Pyrrole-3-carbonitrile,2,5-dimethyl-1-phenyl|3-(3-methyl-1,3-benzothiazol-2-ylidene)pentane-2,4-dione|3-(3-Methyl-3H-benzothiazol-2-ylidene)-pentane-2,4-dione|3-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)pentane-2,4-dione|2,4-Pentanedione, 3-(3-methyl-2(3H)-benzothiazolylidene)-|3-(3-METHYL-2,3-DIHYDRO-1,3-BENZOTHIAZOL-2-YLIDENE)PENTANE-2,4-DIONE
CAS: 64288-87-5
| Molecular Formula | C13H13NO2S |
|---|---|
| Molecular Weight | 247.0667 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.0667 |
| Monoisotopic Mass | 247.0667 |
| Heavy Atoms | 17 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 64288-87-5 |
|---|---|
| SMILES | CC(=O)C(=C1N(C2=CC=CC=C2S1)C)C(=O)C |
| InChIKey | YOVIMCRIWSEEKH-UHFFFAOYSA-N |
Product Overview
Stk326631 (CAS 64288-87-5), with molecular formula C13H13NO2S and molecular weight 247.0667 g/mol. IUPAC: 3-(3-methyl-1,3-benzothiazol-2-ylidene)pentane-2,4-dione.
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.
View MSDS →
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