2-Decanone

• CAS: 693-54-9
• Catalog Number: ACM693549
• Category: Other Products
• Molecular Weight: 156.27
• Molecular Formula: C10H20O
• Synonyms: 2-Oxodecane
• IUPAC Name: Decan-2-one
• Canonical SMILES: CCCCCCCCC(=O)C
• InChI: InChI=1S/C10H20O/c1-3-4-5-6-7-8-9-10(2)11/h3-9H2,1-2H3
• InChI Key: ZAJNGDIORYACQU-UHFFFAOYSA-N
• Melting Point: 3.5 °C(lit.)
• Flash Point: 160 °F
• Density: 0.825 g/mL at 25 °C(lit.)
• Solubility: Soluble in alcohol, insoluble in water
• Appearance: Liquid
• Storage: Store below +30 °C
• Complexity: 97
• Defined Atom Stereocenter Count: 0
• Exact Mass: 156.151415257
• Formal Charge: 0
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 1
• Hydrogen Bond Donor Count: 0
• Isotope Atom Count: 0
• Monoisotopic Mass: 156.151415257
• Refractive Index: n20/D 1.425(lit.)
• Rotatable Bond Count: 7
• Topological Polar Surface Area: 17.1 Ų
• XLogP3-AA: 3.7