Beta-trifluoromethylumbelliferone

• CAS: 575-03-1
• Catalog Number: ACM575031
• Category: Other Fluorophores
• Molecular Weight: 230.14g/mol
• Molecular Formula: C10H5F3O3
• Synonyms: 7-Hydroxy-4-trifluoromethylcoumarin
• IUPAC Name: 7-hydroxy-4-(trifluoromethyl)chromen-2-one
• Canonical SMILES: C1=CC2=C(C=C1O)OC(=O)C=C2C(F)(F)F
• InChI: InChI=1S/C10H5F3O3/c11-10(12,13)7-4-9(15)16-8-3-5(14)1-2-6(7)8/h1-4,14H
• InChI Key: CCKWMCUOHJAVOL-UHFFFAOYSA-N
• Storage: Freeze (<-15 °C); Minimize light exposure
• Complexity: 335
• Covalently-Bonded Unit Count: 1
• Exact Mass: 230.019079g/mol
• Excitation Maximum: 385
• Formal Charge: 0
• H-Bond Acceptor: 6
• H-Bond Donor: 1
• Heavy Atom Count: 16
• Monoisotopic Mass: 230.019079g/mol
• NSC Number: 138174
• Rotatable Bond Count: 0
• XLogP3: 2.4