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| IUPAC Name: | 2,4-ditert-butylphenol |
| Description: | 2,4-Di-tert-butylphenol (CAS# 96-76-4) is a novel selective progesterone steroid receptor modulator. |
| Molecular Weight: | 206.32 |
| Molecular Formula: | C14H22O |
| Canonical SMILES: | CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C |
| InChI: | InChI=1S/C14H22O/c1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6/h7-9,15H,1-6H3 |
| InChI Key: | ICKWICRCANNIBI-UHFFFAOYSA-N |
| Boiling Point: | 264 °C |
| Melting Point: | 54-59 °C |
| Purity: | 97+ % |
| Density: | 0.932 g/cm3 |
| Solubility: | In water, 35 mg/L at 25 °C |
| Appearance: | Light yellow crystals |
| Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
| Decomposition: | When heated to decomposition it emits acrid smoke and fumes |
| MDL: | MFCD00008828 |
| LogP: | 3.98720 |
| Stability: | Stable under recommended storage conditions |
| Vapor Pressure: | 0.0075 [mmHg] |
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