2-Isopropyl-5-methyl-2-hexenal

• CAS: 35158-25-9
• Catalog Number: ACM35158259
• Category: Other Products
• Molecular Weight: 154.25
• Molecular Formula: C₁₀H₁₈O
• Synonyms: Isodihydroavandulyl aldehyde
• IUPAC Name: (E)-5-Methyl-2-propan-2-ylhex-2-enal
• Canonical SMILES: CC(C)CC=C(C=O)C(C)C
• InChI: InChI=1S/C10H18O/c1-8(2)5-6-10(7-11)9(3)4/h6-9H,5H2,1-4H3/b10-6-
• InChI Key: IOLQAHFPDADCHJ-POHAHGRESA-N
• Boiling Point: 189 °C
• Flash Point: 145 °F
• Density: 0.845 g/mL at 25 °C(lit.)
• Solubility: Insoluble in water
• Exact Mass: 154.135765193
• Isomeric SMILES: CC(C)C/C=C(/C=O)\C(C)C
• Monoisotopic Mass: 154.135765193
• Physical State: Liquid
• Refractive Index: n20/D 1.452(lit.)
• Topological Polar Surface Area: 17.1 Ų