Apritone

• CAS: 68133-79-9
• Catalog Number: ACM68133799
• Category: Other Products
• Molecular Weight: 220.35
• Molecular Formula: C₁₅H₂₄O
• Synonyms: Geranyl cyclopentenone
• IUPAC Name: 2-[(2E)-3,7-Dimethylocta-2,6-dienyl]cyclopentan-1-one
• Canonical SMILES: CC(=CCCC(=CCC1CCCC1=O)C)C
• InChI: InChI=1S/C15H24O/c1-12(2)6-4-7-13(3)10-11-14-8-5-9-15(14)16/h6,10,14H,4-5,7-9,11H2,1-3H3/b13-10+
• InChI Key: ZNSALEJHPSBXDK-JLHYYAGUSA-N
• Boiling Point: 309.9±11.0 °C
• Flash Point: 139 °C
• Density: 0.911±0.06 g/cm³
• Solubility: Insoluble in water; soluble in fats
• EC Number: 268-706-3
• Exact Mass: 220.182715385
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Isomeric SMILES: CC(=CCC/C(=C/CC1CCCC1=O)/C)C
• Monoisotopic Mass: 220.182715385
• Odor: Long lasting apricot fruity note
• Physical State: Liquid
• Refractive Index: n20/D 1.482-1.489(lit.)
• Topological Polar Surface Area: 17.1 Ų