1,3-Diacetylindole

CAS: 17537-64-3

Ref. 3D-FD52218

Product Information

• Name: 1,3-Diacetylindole
• Synonyms: 1-(1-Acetyl-1H-indol-3-yl)-1-ethanone1,3-Diacetyl-1H-indole
• Brand: Biosynth
• Description: 1,3-Diacetylindole is an alkene that belongs to the class of organic compounds. It can be prepared by Friedel-Crafts acylation of cyclopentenone with formaldehyde and hydrogen chloride gas. The molecule has a molecular electrostatic potential of -0.8 eV and a molecular weight of 126.1 g/mol. 1,3-Diacetylindole has been shown to react with Grignard reagent in an electrochemical study. Additionally, it has been used as a starting material for the synthesis of other molecules such as 2-methylquinoline and 1,2-dihydroquinoline. The vibrational and spectral data for 1,3-diacetylindole have been obtained using both experimental and computational methods. These data are useful for understanding the structure and reactivity of this compound at the molecular level.br>br> br>br>

Chemical properties

• Molecular weight: 201.22 g/mol
• Formula: C₁₂H₁₁NO₂
• Purity: Min. 95%
• InChI: InChI=1S/C12H11NO2/c1-8(14)11-7-13(9(2)15)12-6-4-3-5-10(11)12/h3-7H,1-2H3
• InChI key: InChIKey=STUZJORZRZCLRI-UHFFFAOYSA-N
• SMILES: CC(=O)c1cn(C(C)=O)c2ccccc12