Organofluorine / Alfa Chemistry
7-(Trifluoromethoxy)-1H-indole

7-(Trifluoromethoxy)-1H-indole

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7-(Trifluoromethoxy)-1H-indole
Catalog OFC396075915
CAS 396075-91-5
Category Fluorinated Indoles
Synonyms 7-(Trifluoromethoxy)indole
Purity 95%
MDL Number MFCD11109870
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 7-(trifluoromethoxy)-1H-indole
InChI InChI=1S/C9H6F3NO/c10-9(11,12)14-7-3-1-2-6-4-5-13-8(6)7/h1-5,13H
InChI Key VWWNXBVHASKIKY-UHFFFAOYSA-N
Isomeric SMILES C1=CC2=C(C(=C1)OC(F)(F)F)NC=C2
Molecular Formula C9H6F3NO
Molecular Weight 201.15
Storage Sealed in dry, 2-8 °C
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 201.04014830 g/mol
Monoisotopic Mass 201.04014830 g/mol
Topological Polar Surface Area 25Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 207

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