3-Methyl-2-(perfluoropropyl)-1H-indole

• Catalog: OFC1030606428
• CAS: 1030606-42-8
• Category: Fluorinated Indoles
• Synonyms: 2-(Heptafluoropropyl)-3-methyl-1H-indole
• Purity: >95%

• IUPAC Name: 2-(1,1,2,2,3,3,3-heptafluoropropyl)-3-methyl-1H-indole
• InChI: InChI=1S/C12H8F7N/c1-6-7-4-2-3-5-8(7)20-9(6)10(13,14)11(15,16)12(17,18)19/h2-5,20H,1H3
• InChI Key: FMUNPDCTOUKDBU-UHFFFAOYSA-N
• Isomeric SMILES: CC1=C(NC2=CC=CC=C12)C(C(C(F)(F)F)(F)F)(F)F

• Molecular Formula: C12H8F7N
• Molecular Weight: 299.19
• Storage: Sealed in dry, 2-8 °C

• XLogP3-AA: 4.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 299.05449639 g/mol
• Monoisotopic Mass: 299.05449639 g/mol
• Topological Polar Surface Area: 15.8Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 365