2,2,2-Trifluoro-1-(1H-indol-5-yl)ethanone

• Catalog: OFC170366902
• CAS: 170366-90-2
• Category: Fluorinated Indoles
• Synonyms: Ethanone, 2,2,2-trifluoro-1-(1H-indol-5-yl)- (9CI)
• Purity: 95%
• MDL Number: MFCD13173250

• IUPAC Name: 2,2,2-trifluoro-1-(1H-indol-5-yl)ethanone
• InChI: InChI=1S/C10H6F3NO/c11-10(12,13)9(15)7-1-2-8-6(5-7)3-4-14-8/h1-5,14H
• InChI Key: BEAXZGXRMVALGL-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC2=C(C=CN2)C=C1C(=O)C(F)(F)F

• Molecular Formula: C10H6F3NO
• Molecular Weight: 213.16
• Storage: Sealed in dry, room temperature

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 213.04014830 g/mol
• Monoisotopic Mass: 213.04014830 g/mol
• Topological Polar Surface Area: 32.9Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 264