Cas no 1018971-85-1 (2-methyl-4-(trifluoromethyl)-1H-Indole)

2-methyl-4-(trifluoromethyl)-1H-Indole structure
1018971-85-1 structure
Product Name:2-methyl-4-(trifluoromethyl)-1H-Indole
CAS No:1018971-85-1
MF:C10H8F3N
MW:199.172432899475
CID:1096482
PubChem ID:19697022
Update Time:2025-04-20

2-methyl-4-(trifluoromethyl)-1H-Indole Chemical and Physical Properties

Names and Identifiers

    • 2-methyl-4-(trifluoromethyl)-1H-Indole
    • DB-192994
    • 1018971-85-1
    • 2-methyl-4-trifluoromethylindole
    • 2-methyl-4-trifluoromethyl-1H-indole
    • SCHEMBL2427359
    • Inchi: 1S/C10H8F3N/c1-6-5-7-8(10(11,12)13)3-2-4-9(7)14-6/h2-5,14H,1H3
    • InChI Key: TURWIQQQNMXJMX-UHFFFAOYSA-N
    • SMILES: FC(C1=CC=CC2=C1C=C(C)N2)(F)F

Computed Properties

  • Exact Mass: 199.060884g/mol
  • Monoisotopic Mass: 199.060884g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 214
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 199.17g/mol
  • XLogP3: 3.3
  • Topological Polar Surface Area: 15.8?2
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