1-(5,5-Dimethyl-1-cyclohexen-1-yl)-4-penten-1-one

• CAS: 56973-85-4
• Catalog Number: ACM56973854
• Category: Other Products
• Molecular Weight: 192.3
• Molecular Formula: C13H20O
• Synonyms: Dynascone
• IUPAC Name: 1-(5,5-Dimethylcyclohexen-1-yl)pent-4-en-1-one
• Canonical SMILES: CC1(CCC=C(C1)C(=O)CCC=C)C
• InChI: InChI=1S/C13H20O/c1-4-5-8-12(14)11-7-6-9-13(2,3)10-11/h4,7H,1,5-6,8-10H2,2-3H3
• InChI Key: OEVIJAZJVZDBQL-UHFFFAOYSA-N
• Boiling Point: 268.6±29.0 °C
• Flash Point: >100 °C
• Density: 0.906±0.06 g/cm³
• Assay: 0.98
• EC Number: 260-486-7
• Exact Mass: 192.151415257
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Monoisotopic Mass: 192.151415257
• Packaging: 1 kg
• Physical State: Liquid
• Refractive Index: n20/D 1.444-1.448(lit.)
• Topological Polar Surface Area: 17.1 Ų