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| IUPAC Name: | 4-propan-2-ylbenzaldehyde |
| Description: | Cuminaldehyde (CAS# 122-03-2) is a lipoxygenase and alpha-synuclein inhibitor. 4-Isopropylbenzaldehyde could also be used as a drug for chemopreventive or anticancer therapy. |
| Molecular Weight: | 148.20 |
| Molecular Formula: | C10H12O |
| Canonical SMILES: | CC(C)C1=CC=C(C=C1)C=O |
| InChI: | InChI=1S/C10H12O/c1-8(2)10-5-3-9(7-11)4-6-10/h3-8H,1-2H3 |
| InChI Key: | WTWBUQJHJGUZCY-UHFFFAOYSA-N |
| Boiling Point: | 234-235 ℃ |
| Melting Point: | 235-236°C(lit.) |
| Flash Point: | 93°C |
| Purity: | > 97.0 % (GC) |
| Density: | 0.979 g/cm3 |
| Solubility: | water, 282 mg/L @ 20 °C (exp) |
| Appearance: | Clear colorless to yellow liquid |
| Storage: | Inert atmosphere, 2-8 ℃ |
| MDL: | MFCD00006953 |
| LogP: | 2.62250 |
| Refractive Index: | 1.529-1.532 |
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