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| Related CAS: | 57-15-8 (anhydrous) |
| IUPAC Name: | 1,1,1-trichloro-2-methylpropan-2-ol;hydrate |
| Description: | Chlorbutanol Hemihydrate acts as a fish anaesthetic, primarily on members of the octopus species. Also used as an ophthalmic antimicrobial preservative agent (1). |
| Molecular Weight: | 186.46 |
| Molecular Formula: | C4H7Cl3O.(1/2H2O) |
| Canonical SMILES: | CC(C)(C(Cl)(Cl)Cl)O.CC(C)(C(Cl)(Cl)Cl)O.O |
| InChI: | InChI=1S/2C4H7Cl3O.H2O/c2*1-3(2,8)4(5,6)7;/h2*8H,1-2H3;1H2 |
| InChI Key: | WRWLCXJYIMRJIN-UHFFFAOYSA-N |
| Boiling Point: | 173-175°C |
| Melting Point: | 77-79°C |
| Purity: | 98% |
| Solubility: | Soluble in Chloroform (Slightly), Methanol (Slightly) |
| Appearance: | White crystalline solid |
| Storage: | Store at 2-8°C under inert atmosphere |
| MDL: | MFCD00149293 |
| LogP: | 2.06320 |
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(Z)-N-(4-Phenylpiperazin-1-yl)-1-(2,3,4-trimethoxyphenyl)methanimine
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