14-Heptacosanone

• Catalog Number: ACM542507
• Product Name: 14-Heptacosanone
• CAS: 542-50-7
• Category: Heterocyclic Organic Compound
• Synonyms: Myristic ketone
• IUPAC Name: Heptacosan-14-one
• Molecular Weight: 394.7
• Molecular Formula: C₂₇H₅₄O
• Canonical SMILES: CCCCCCCCCCCCCC(=O)CCCCCCCCCCCCC
• InChI: InChI=1S/C27H54O/c1-3-5-7-9-11-13-15-17-19-21-23-25-27(28)26-24-22-20-18-16-14-12-10-8-6-4-2/h3-26H2,1-2H3
• InChI Key: VCZMOZVQLARCOE-UHFFFAOYSA-N
• Boiling Point: 443.86 °C
• Melting Point: 76-78 °C
• Flash Point: 56.1ºC
• Density: 0.8686 g/mL at 20 °C(lit.)
• EC Number: 208-815-5
• Exact Mass: 394.417466342
• Hazard Statements: Xi,N
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Monoisotopic Mass: 394.417466342
• Physical State: Solid
• Refractive Index: n20/D 1.4758(lit.)
• Safety Description: S37/39:Wear suitable gloves and eye/face protection .; S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .; S61:Avoid release to the environment. Refer to special instructions safety data sheet .
• Storage Conditions: Room Temperature
• Topological Polar Surface Area: 17.1 Ų