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| IUPAC Name: | ethyl (2S)-2,6-diisothiocyanatohexanoate |
| Description: | 2,6-Diisothiocyanato-Hexanoic Acid Ethyl Ester is a reagent used in the synthesis of compounds displaying cytotoxic, genotoxic and antimicrobial activity. |
| Molecular Weight: | 258.36 |
| Molecular Formula: | C10H14N2O2S2 |
| Canonical SMILES: | CCOC(=O)C(CCCCN=C=S)N=C=S |
| InChI: | InChI=1S/C10H14N2O2S2/c1-2-14-10(13)9(12-8-16)5-3-4-6-11-7-15/h9H,2-6H2,1H3/t9-/m0/s1 |
| InChI Key: | QJXQTXCTKSKWGP-VIFPVBQESA-N |
| Solubility: | Chloroform, Ethyl Acetate, Methanol |
| Appearance: | Clear Pale Yellow Oil |
| Storage: | 4°C, Hygroscopic |
| References: | Horakova, K. et al. Biolog., 44, 637 (1989). |
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