4-(2-FURYL)-3-BUTEN-2-ONE

• CAS: 623-15-4
• Catalog Number: ACM623154
• Category: Other Products
• Molecular Weight: 136.15
• Molecular Formula: C8H8O2
• Synonyms: 2-Furfurylideneacetone
• IUPAC Name: (E)-4-(Furan-2-yl)but-3-en-2-one
• Canonical SMILES: CC(=O)C=CC1=CC=CO1
• InChI: InChI=1S/C8H8O2/c1-7(9)4-5-8-3-2-6-10-8/h2-6H,1H3/b5-4+
• InChI Key: GBKGJMYPQZODMI-SNAWJCMRSA-N
• Boiling Point: 112-115ºC 10mm
• Melting Point: 34-41 °C(lit.)
• Flash Point: 220 °F
• Density: 1.0496 g/cm³
• Solubility: Insoluble in water
• Appearance: Solid
• Storage: Under inert gas (nitrogen or argon) at 2-8 °C
• Complexity: 149
• Exact Mass: 136.052429494
• Hazard Statements: Xi
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Isomeric SMILES: CC(=O)/C=C/C1=CC=CO1
• Monoisotopic Mass: 136.052429494
• Refractive Index: n20/D 1.565(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 .
• Stability: Flammable. Incompatible with strong oxidizing agents.
• Topological Polar Surface Area: 30.2 Ų
• WGK Germany: 3