2-Pentadecanone

• Catalog Number: ACM2345280
• Product Name: 2-Pentadecanone
• CAS: 2345-28-0
• Category: Heterocyclic Organic Compound
• Description: 2-Pentadecanone is a marine derived natural products found in Caulocystis cephalornithos.
• Synonyms: Pentadecan-2-one
• IUPAC Name: 1-Methyl-4-propan-2-ylbenzene
• Molecular Weight: 226.4
• Molecular Formula: C15H30O
• Canonical SMILES: CC1=CC=C(C=C1)C(C)C
• InChI: InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3
• InChI Key: HFPZCAJZSCWRBC-UHFFFAOYSA-N
• Boiling Point: 293 °C(lit.)
• Melting Point: 37-41 °C(lit.)
• Flash Point: >230 °F
• Density: 0.82 g/cm³
• Solubility: Soluble in toluene, insoluble in water
• Appearance: Liquid
• Storage: Sealed in dry, room temperature
• Complexity: 86.2
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Exact Mass: 134.109550447
• Heavy Atom Count: 16
• Monoisotopic Mass: 134.109550447
• Physical State: Powder
• Refractive Index: 1.4421
• Storage Conditions: Powder: -20°C for 3 years In solvent: -80°C for 2 years
• Topological Polar Surface Area: 0 Ų