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| IUPAC Name: | 4-tert-butylbenzoic acid |
| Description: | 4-tert-Butylbenzoic acid (CAS# 98-73-7) is a useful research chemical. |
| Molecular Weight: | 178.23 |
| Molecular Formula: | C11H14O2 |
| Canonical SMILES: | CC(C)(C)C1=CC=C(C=C1)C(=O)O |
| InChI: | InChI=1S/C11H14O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H,12,13) |
| InChI Key: | KDVYCTOWXSLNNI-UHFFFAOYSA-N |
| Boiling Point: | 283.3 °C at 760 mmHg |
| Melting Point: | 164-167 °C |
| Flash Point: | 180°C |
| Purity: | 98 % |
| Density: | 0.6 g/cm3 |
| Solubility: | water, 28.94 mg/L @ 25 °C (est) |
| Appearance: | White to slightly yellow flakes |
| Storage: | Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
| MDL: | MFCD00002563 |
| LogP: | 2.68230 |
| Stability: | Stable under normal temperatures and pressures. |
| Vapor Pressure: | 0.000636 [mmHg] |
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