Trans-Chalcone

• CAS: 614-47-1
• Catalog Number: ACM614471
• Category: Inhibitors
• Molecular Weight: 208.26
• Molecular Formula: C15H12O
• Description: trans-Chalcone, isolated from Aronia melanocarpa skin, is a biphenolic core structure of flavonoids precursor. trans-Chalcone is a potent fatty acid synthase (FAS) and α-amylase inhibitor. trans-Chalcone causes cellcycle arrest and induces apoptosis in the breastcancer cell line MCF-7. trans-Chalcone has antifungal and anticancer activity.
• Synonyms: Phenyltrans-styrylketone
• IUPAC Name: (E)-1,3-Diphenylprop-2-en-1-one
• Canonical SMILES: C1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2
• InChI: InChI=1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H/b12-11+
• InChI Key: DQFBYFPFKXHELB-VAWYXSNFSA-N
• Boiling Point: 208 °C/25 mmHg(lit.)
• Melting Point: 55-59 °C
• Flash Point: >230 °F
• Density: 1.0712 g/cm³
• Appearance: Pale yellow solid
• Storage: Sealed in dry, room temperature
• Complexity: 242
• EC Number: 210-383-8
• Exact Mass: 208.088815002
• Hazard Statements: Xn:Harmful
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Isomeric SMILES: C1=CC=C(C=C1)/C=C/C(=O)C2=CC=CC=C2
• Monoisotopic Mass: 208.088815002
• Refractive Index: 1.5361
• Safety Description: S22-S36/37/39-S45
• Shipping: Can be shipped at room temperature, where not in use may vary.
• Source: PlantsRosaceaeAronia melanocarpa
• Stability: Stable at normal temperatures and pressures.
• Topological Polar Surface Area: 17.1 Ų
• WGK Germany: 3